SCHEMBL110291

SCHEMBL110291

CCCC[Sn](CCCC)(CCCC)c1cnccn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 3/20 0.40
CYP19A1 P11511 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
KDM4E B2RXH2 1/20 0.37
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
RAB9A P51151 2/20 0.33
CYP3A4 P08684 2/20 0.33
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KMT2A Q03164 2/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
HPGD P15428 1/20 0.33
HSP90AA1 P07900 1/20 0.31

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
SCHEMBL2961237 1.00 CYP2D6 (0.40) CYP2D6CYP19A1CYP2C9CYP2C19KDM4E
SCHEMBL2112054 0.82 CYP2D6 (0.32) CYP2D6CYP19A1CYP2C9CYP2C19KDM4E
SCHEMBL29785697 0.73 KDM4E (0.33) KDM4EMAPTHPGD
SCHEMBL28786363 0.73 KDM4E (0.33) KDM4EMAPTHPGD
SCHEMBL29390052 0.73 CYP1A2 (0.41) CYP2D6CYP19A1CYP2C9CYP2C19KDM4E
SCHEMBL28505 0.73 CYP1A2 (0.41) CYP2D6CYP19A1CYP2C9CYP2C19KDM4E
SCHEMBL4037008 0.73 CYP1A2 (0.41) CYP2D6CYP19A1CYP2C9CYP2C19KDM4E
SCHEMBL2416251 0.72
SCHEMBL1763340 0.72 GABRP (0.34) KDM4ERAB9ANPC1
SCHEMBL1417302 0.72 CYP2D6 (0.42) CYP2D6KDM4ETDP1L3MBTL1RAB9A

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 1115 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4745117-A1 NOVEL INDENONE DERIVATIVE AND USE THEREOF Amyloid Solution Inc. (KR) 2026-05-20 EP disclosed
US-20260132126-A1 IMIDAZOLE DERIVATIVES SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 2026-05-14 US disclosed
EP-4741392-A1 1H-PYRAZOLO[4,3-C]PYRIDINE COMPOUND, AND COMPOSITION THEREOF AND USE THEREOF Shenzhen TargetRx Co., Ltd. (CN) 2026-05-13 EP disclosed
US-20260124205-A1 MODULATORS OF BETA CATENIN AND USES THEREOF DEWPOINT THERAPEUTICS INC (US) 2026-05-07 US disclosed
US-20260102395-A1 INHIBITING HISTONE DEACETYLASE 6 EIKONIZO THERAPEUTICS, INC. (US) 2026-04-16 US disclosed
US-20260098026-A1 M4 ACTIVATORS/MODULATORS AND USES THEREOF CEREVEL THERAPEUTICS LLC (US) 2026-04-09 US disclosed
US-20260098044-A1 TRICYCLIC HETEROARYL COMPOUNDS AS INHIBITORS OF TYK2 AND/OR JAK1 INCYTE CORP (US) 2026-04-09 US disclosed
US-12595258-B2 Heterocyclic derivatives, pharmaceutical compositions and their use in the treatment or amelioration of cancer TOLREMO THERAPEUTICS AG (CH) 2026-04-07 US disclosed
US-20260092053-A1 KHK INHIBITORS GILEAD SCIENCES INC (US) 2026-04-02 US disclosed
US-20260085056-A1 OX1 RECEPTOR ANTAGONISTS NXERA PHARMA UK LIMITED (GB) 2026-03-26 US disclosed
US-6054435-A 6-O-substituted macrolides having antibacterial activity ABBOTT LABORATORIES (US) 2000-04-25 US disclosed
US-6046195-A Spiro-azacyclic derivatives, their preparation and their use as tachykinin antagonists MERCK SHARP & DOHME LTD. (GB) 2000-04-04 US disclosed
WO-2000010566-A1 NOVEL ISOXAZOLINONE ANTIBACTERIAL AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2000-03-02 WO disclosed
EP-0623622-B1 PROCESS FOR PRODUCING CEPHEM COMPOUND OTSUKA KAGAKU KK (JP) 1999-10-06 EP disclosed
EP-0937072-A1 THIENYLCYCLOHEXANONE DERIVATIVES AS LIGANDS OF THE GABA A? $g(a)5 RECEPTOR SUBTYPE MERCK SHARP & DOHME LTD. (GB) 1999-08-25 EP disclosed
EP-0929554-A1 SPIRO-AZACYCLIC DERIVATIVES, THEIR PREPARATION AND THEIR USE AS TACHYKININ ANTAGONISTS MERCK SHARP & DOHME LTD. (GB) 1999-07-21 EP disclosed
WO-1998018792-A1 THIENYLCYCLOHEXANONE DERIVATIVES AS LIGANDS OF THE GABAA α5 RECEPTOR SUBTYPE MERCK SHARP & DOHME LIMITED (GB) 1998-05-07 WO disclosed
WO-1998013369-A1 SPIRO-AZACYCLIC DERIVATIVES, THEIR PREPARATION AND THEIR USE AS TACHYKININ ANTAGONISTS MERCK SHARP & DOHME LIMITED (GB) 1998-04-02 WO disclosed
US-5656754-A REACTING AN ALLENYL-B-LACTAM COMPOUND WITH AN ORGANOTIN COMPOUND OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1997-08-12 US disclosed
EP-0623622-A1 PROCESS FOR PRODUCING CEPHEM COMPOUND OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1994-11-09 EP 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 (8 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-12595258-B2 Heterocyclic derivatives, pharmaceutical compositions and their use in the treatment or amelioration of cancer SLC10A1, MAPT, SLC6A6 CYP2D6 266/4885CYP19A1 472/4885CYP2C9 473/4885
US-20260132126-A1 IMIDAZOLE DERIVATIVES ADRA1A, ADRA1D, ADRB1 CYP2D6 787/4885CYP19A1 1981/4885CYP2C9 1546/4885
US-20260098026-A1 M4 ACTIVATORS/MODULATORS AND USES THEREOF CHRM1, CHRM2, CHRM4 CYP2D6 268/4885CYP19A1 2503/4885CYP2C9 1309/4885
US-20260124205-A1 MODULATORS OF BETA CATENIN AND USES THEREOF CTNNB1, CTNNA1, CTNND1 CYP2D6 2689/4885CYP19A1 2273/4885CYP2C9 3684/4885
US-20260085056-A1 OX1 RECEPTOR ANTAGONISTS CNR1, CNR2, OPRM1 CYP2D6 611/4885CYP19A1 1861/4885CYP2C9 515/4885
US-20260092053-A1 KHK INHIBITORS KHK, SLC5A2, HK1 CYP2D6 1293/4885CYP19A1 3875/4885CYP2C9 377/4885
US-20260102395-A1 INHIBITING HISTONE DEACETYLASE 6 HDAC6, HDAC1, HDAC8 CYP2D6 2410/4885CYP19A1 4433/4885CYP2C9 3810/4885
US-20260098044-A1 TRICYCLIC HETEROARYL COMPOUNDS AS INHIBITORS OF TYK2 AND/OR JAK1 JAK1, TYK2, JAK2 CYP2D6 1054/4885CYP19A1 2919/4885CYP2C9 2254/4885

“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.