SCHEMBL8038110

SCHEMBL8038110

O=Cc1ccccc1OCc1ccccn1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
HPGD P15428 1/20 0.59
HTT P42858 1/20 0.59
KDM4E B2RXH2 3/20 0.58
ABCB1 P08183 1/20 0.51
HTR1A P08908 1/20 0.51
DRD2 P14416 1/20 0.51
SYK P43405 3/20 0.50
PTGDR2 Q9Y5Y4 1/20 0.50
POLB P06746 1/20 0.50
RECQL P46063 1/20 0.50
AURKB Q96GD4 2/20 0.49
INCENP Q9NQS7 2/20 0.49

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
SCHEMBL28707829 0.87 SYK (0.55) ALDH1A1SMN1; SMN2HPGDHTTKDM4E
SCHEMBL8424814 0.85 HPGD (0.62) ALDH1A1SMN1; SMN2HPGDHTTKDM4E
SCHEMBL15474965 0.84 SYK (0.52) ALDH1A1SMN1; SMN2KDM4EABCB1HTR1A
SCHEMBL4937535 0.82 PTGDR2 (0.52) ALDH1A1SMN1; SMN2KDM4EABCB1HTR1A
SCHEMBL636851 0.82 NPC1 (0.57) ALDH1A1SMN1; SMN2KDM4EABCB1HTR1A
SCHEMBL7669830 0.80 KDM4E (0.49) ALDH1A1SMN1; SMN2KDM4EABCB1HTR1A
SCHEMBL15474708 0.80 SYK (0.63) ALDH1A1SMN1; SMN2KDM4EABCB1HTR1A
SCHEMBL15474645 0.80 SYK (0.63) ALDH1A1SMN1; SMN2KDM4EABCB1HTR1A
SCHEMBL31467948 0.78 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2HPGDHTTKDM4E
SCHEMBL15475165 0.78 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2KDM4ESYKAURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230104936-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. 2023-04-06 US disclosed
EP-4076423-A1 TRPML MODULATORS Casma Therapeutics, Inc. (US) 2022-10-26 EP disclosed
CN-115087440-A TRPML modulators 卡斯玛治疗公司 2022-09-20 CN disclosed
WO-2021127328-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. (US) 2021-06-24 WO disclosed
WO-2021127337-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. (US) 2021-06-24 WO disclosed
WO-2021127333-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. (US) 2021-06-24 WO disclosed
US-20210070756-A1 TETRACYCLIC BROMODOMAIN INHIBITORS ABBVIE INC (US) 2021-03-11 US disclosed
US-20200291027-A1 TETRACYCLIC BROMODOMAIN INHIBITORS ABBVIE INC (US) 2020-09-17 US disclosed
EP-3539962-A1 TETRACYCLIC BROMODOMAIN INHIBITORS AbbVie Inc. (US) 2019-09-18 EP disclosed
EP-3323816-B1 NOVEL PYRAZOLE DERIVATIVE GREEN TECHNOLOGY CO LTD (JP) 2019-07-03 EP disclosed
US-20140088029-A1 NOVEL PYRAZOLE DERIVATIVE PHARMA EIGHT CO., LTD. (JP) 2014-03-27 US disclosed
EP-2698368-A1 NOVEL PYRAZOLE DERIVATIVE Pharma Eight Co. Ltd (JP) 2014-02-19 EP disclosed
WO-2000076990-A1 NEW COMPOUNDS ASTRAZENECA AB (SE) 2000-12-21 WO disclosed
EP-0938494-A1 INHIBITORS OF PROTEIN FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 1999-09-01 EP disclosed
WO-1997044350-A1 INHIBITORS OF PROTEIN FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 1997-11-27 WO disclosed
EP-0365328-B1 Pyridine derivatives ZENECA LTD (GB) 1996-04-03 EP disclosed
US-5053415-A Antiischemic, antiinflammatory, antiarthritic agents, cardiovascular disorders IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-10-01 US disclosed
EP-0365328-A2 Pyridine derivatives ZENECA LIMITED (GB) 1990-04-25 EP disclosed
US-4600719-A Tetrahydropyridine and piperidine derivatives CIBA GEIGY CORPORATION (US) 1986-07-15 US disclosed
US-4210655-A Anti-depressant benzofuranyl piperidines CIBA-GEIGY CORPORATION (US) 1980-07-01 US 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 (4 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-20200291027-A1 TETRACYCLIC BROMODOMAIN INHIBITORS BRD3, BRD4, BRD1 ALDH1A1 2163/4885SMN1; SMN2 3542/4885HPGD 2388/4885
US-20210070756-A1 TETRACYCLIC BROMODOMAIN INHIBITORS BRD3, BRD4, BRD1 ALDH1A1 2163/4885SMN1; SMN2 3542/4885HPGD 2388/4885
US-20140088029-A1 NOVEL PYRAZOLE DERIVATIVE PSEN2, MAPT, PSEN1 ALDH1A1 675/4885SMN1; SMN2 1138/4885HPGD 2351/4885
US-20230104936-A1 TRPML MODULATORS TRPM2, TRPM4, TRPM5 ALDH1A1 3737/4885SMN1; SMN2 1776/4885HPGD 2040/4885

“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.