SCHEMBL1005591

SCHEMBL1005591

C[C@H](CO)NCc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.68
POLB P06746 2/20 0.53
MAPK1 P28482 1/20 0.49
TRPA1 O75762 1/20 0.48
BCHE P06276 1/20 0.47
GAA P10253 1/20 0.47
ATM Q13315 1/20 0.47
THRB P10828 1/20 0.46
IDO1 P14902 1/20 0.46
LMNA P02545 1/20 0.46
TAAR1 Q96RJ0 2/20 0.45
SLC18A2 Q05940 1/20 0.45
MAPT P10636 2/20 0.45
KDM4E B2RXH2 1/20 0.45
CYP3A4 P08684 1/20 0.45
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
ACP3 P15309 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1005593 1.00 SIGMAR1 (0.68) SIGMAR1POLBMAPK1TRPA1BCHE
SCHEMBL1189292 1.00 SIGMAR1 (0.68) SIGMAR1POLBMAPK1TRPA1BCHE
SCHEMBL1752567 0.89 SIGMAR1 (0.59) SIGMAR1POLBMAPK1BCHELMNA
SCHEMBL31127843 0.84 SIGMAR1 (0.63) SIGMAR1POLBMAPK1BCHEGAA
SCHEMBL536907 0.84 SIGMAR1 (0.63) SIGMAR1POLBMAPK1BCHEGAA
N-Benzylamphetamine SCHEMBL2451256 0.81 SIGMAR1 (1.00) SIGMAR1POLBMAPK1LMNATAAR1
SCHEMBL172633 0.81 SIGMAR1 (0.70) SIGMAR1POLBMAPK1BCHELMNA
N-Benzylamphetamine SCHEMBL2795222 0.81 SIGMAR1 (1.00) SIGMAR1POLBMAPK1LMNATAAR1
N-Benzylamphetamine SCHEMBL2798189 0.81 SIGMAR1 (1.00) SIGMAR1POLBMAPK1LMNATAAR1
SCHEMBL13675825 0.81 SIGMAR1 (0.70) SIGMAR1POLBMAPK1BCHELMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 104 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110183471-B Piperazine derivative, preparation method and application 江苏大学 2022-02-15 CN claimed
EP-4727591-A1 SMARCA2 DEGRADERS AND USES THEREOF Astrazeneca AB (SE) 2026-04-22 EP disclosed
US-12319679-B2 Morpholinyl, piperazinyl, oxazepanyl and diazepanyl O-glycoprotein-2-acetamido-2-deoxy-3-d-glucopyranosidase inhibitors BIOGEN MA INC. (US) 2025-06-03 US disclosed
US-20250066313-A1 Methods of Synthesis of Chiral 3,5-Disubstituted Morpholine Compounds and Intermediates Useful Therein BEONE MEDICINES I GMBH (CH) 2025-02-27 US disclosed
WO-2024256988-A1 SMARCA2 DEGRADERS AND USES THEREOF ASTRAZENECA AB (SE) 2024-12-19 WO disclosed
EP-4441027-A1 METHODS OF SYNTHESIS OF CHIRAL 3, 5-DISUBSTITUTED MORPHOLINE COMPOUNDS AND INTERMEDIATES USEFUL THEREIN BeiGene Switzerland GmbH (CH) 2024-10-09 EP disclosed
CN-118317943-A Synthesis method of chiral 3, 5-disubstituted morpholine compound and useful intermediate thereof 百济神州有限公司 2024-07-09 CN disclosed
EP-4327814-A2 MORPHOLINYL, PIPERAZINYL, OXAZEPANYL AND DIAZEPANYL O-GLYCOPROTEIN-2-ACETAMIDO-2-DEOXY-3-D-GLUCOPYRANOSIDASE INHIBITORS Biogen MA Inc. (US) 2024-02-28 EP disclosed
US-20230406851-A1 IMIDAZOPYRIDINE COMPOUNDS AND USES THEREOF GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.3) LIMITED (GB) 2023-12-21 US disclosed
EP-3891146-B1 MORPHOLINYL, PIPERAZINYL, OXAZEPANYL AND DIAZEPANYL DERIVATIVES USEFUL AS O-GLYCOPROTEIN-2-ACETAMIDO-2-DEOXY-3-D-GLUCOPYRANOSIDASE INHIBITORS BIOGEN MA INC (US) 2023-09-27 EP disclosed
US-20080255114-A1 2-AMINOBENZOXAZOLE CARBOXAMIDES AS 5HT3 MODULATORS AMR TECHNOLOGY, INC. (US) 2008-10-16 US disclosed
US-20060199817-A1 Phthalazine, aza- and diaza-phthalazine compounds and methods of use AMGEN INC. (US) 2006-09-07 US disclosed
EP-1692085-A2 INHIBITION OF FGFR3 AND TREATMENT OF MULTIPLE MYELOMA Chiron Corporation (US) 2006-08-23 EP disclosed
US-20050261307-A1 Inhibition of FGFR3 and treatment of multiple myeloma CHIRON CORPORATION 2005-11-24 US disclosed
US-20050256157-A1 Combination therapy with CHK1 inhibitors CHIRON CORPORATION 2005-11-17 US disclosed
US-20050203101-A1 Benzimidazole quinolinones and uses thereof CHIRON CORPORATION 2005-09-15 US disclosed
EP-1539754-A2 BENZIMIDAZOLE QUINOLINONES AND USES THEREOF Chiron Corporation (US) 2005-06-15 EP disclosed
WO-2005047244-A2 INHIBITION OF FGFR3 AND TREATMENT OF MULTIPLE MYELOMA CHIRON CORPORATION (US) 2005-05-26 WO disclosed
US-20040092535-A1 Benzimidazole quinolinones and uses thereof CHIRON CORPORATION 2004-05-13 US disclosed
WO-2004018419-A2 BENZIMIDAZOLE QUINOLINONES AND USES THEREOF CHIRON CORPORATION (US) 2004-03-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060199817-A1 Phthalazine, aza- and diaza-phthalazine compounds and methods of use DAPK2, CDK2, DAPK1 SIGMAR1 4462/4885POLB 2547/4885MAPK1 111/4885
US-20050256157-A1 Combination therapy with CHK1 inhibitors CHEK1, CHEK2, RAD1 SIGMAR1 4811/4885POLB 253/4885MAPK1 398/4885
US-20050261307-A1 Inhibition of FGFR3 and treatment of multiple myeloma FGFR3, FGFR1, FGFR2 SIGMAR1 4880/4885POLB 4810/4885MAPK1 510/4885
US-20230406851-A1 IMIDAZOPYRIDINE COMPOUNDS AND USES THEREOF NISCH, ABL1, PAICS SIGMAR1 2026/4885POLB 2726/4885MAPK1 2046/4885
US-12319679-B2 Morpholinyl, piperazinyl, oxazepanyl and diazepanyl O-glycoprotein-2-acetamido-2-deoxy-3-d-glucopyranosidase inhibitors MAN2A1, MAN2B2, MGAT3 SIGMAR1 2022/4885POLB 3038/4885MAPK1 2547/4885
US-20080255114-A1 2-AMINOBENZOXAZOLE CARBOXAMIDES AS 5HT3 MODULATORS HTR3E, HTR3C, HTR3A SIGMAR1 834/4885POLB 1879/4885MAPK1 4306/4885
US-20050203101-A1 Benzimidazole quinolinones and uses thereof H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, TP53, PBRM1 SIGMAR1 1105/4885POLB 2662/4885MAPK1 3484/4885
US-20040092535-A1 Benzimidazole quinolinones and uses thereof GAA, ALPI, IL4I1 SIGMAR1 3209/4885POLB 708/4885MAPK1 2918/4885
US-20250066313-A1 Methods of Synthesis of Chiral 3,5-Disubstituted Morpholine Compounds and Intermediates Useful Therein BAD, BID, AIFM1 SIGMAR1 2275/4885POLB 322/4885MAPK1 2490/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.