SCHEMBL4635750

SCHEMBL4635750

Fc1ccc(SCc2ccccn2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.53
NPC1 O15118 5/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
KDM4E B2RXH2 3/20 0.49
DAO P14920 1/20 0.48
MAPT P10636 4/20 0.46
ALDH1A1 P00352 4/20 0.45
CYP1A2 P05177 2/20 0.45
CYP2E1 P05181 1/20 0.45
CYP2C8 P10632 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2B6 P20813 1/20 0.45
CYP2C19 P33261 1/20 0.45
HTR1A P08908 1/20 0.44
DRD2 P14416 1/20 0.44
ADRA2C P18825 1/20 0.44
DRD1 P21728 1/20 0.44
DRD5 P21918 1/20 0.44
HTR2A P28223 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
SCHEMBL29405082 0.85 NPC1 (0.59) RAB9ANPC1SMN1; SMN2KDM4EDAO
SCHEMBL432670 0.85 NPC1 (0.59) RAB9ANPC1SMN1; SMN2KDM4EDAO
SCHEMBL15702601 0.83 ALDH1A1 (0.66) RAB9ANPC1SMN1; SMN2KDM4EMAPT
SCHEMBL8362996 0.82 NPC1 (0.56) RAB9ANPC1SMN1; SMN2KDM4EDAO
SCHEMBL9656225 0.82 DAO (0.55) RAB9ANPC1SMN1; SMN2KDM4EDAO
SCHEMBL11163593 0.82 NPC1 (0.58) RAB9ANPC1SMN1; SMN2KDM4EDAO
SCHEMBL1457922 0.82 NPC1 (0.53) RAB9ANPC1SMN1; SMN2KDM4EDAO
SCHEMBL3388873 0.82 L3MBTL1 (0.54) RAB9ANPC1SMN1; SMN2KDM4EDAO
SCHEMBL11231567 0.81 MAPT (0.55) RAB9ANPC1SMN1; SMN2KDM4EDAO
Hydrochloric Acid SCHEMBL11174365 0.81 NPC1 (0.57) RAB9ANPC1SMN1; SMN2KDM4EDAO

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4394509-A CHEMICAL INTERMEDIATES FOR SULFOXIDE DERIVATIVES USEFUL AS ANTIULCER AND ANTISECRETORY AGENTS JOHN WYETH AND BROTHER LIMITED (GB) 1983-07-19 US claimed
US-20080306109-A1 Indolizine Derivatives as Ligands of the Crth2 Receptor ARGENTA DISCOVERY LIMITED (GB) 2008-12-11 US disclosed
CN-101305001-A Indolizine derivatives as ligands of the CRTH2 receptor ARGENTA DISCOVERY LTD (GB) 2008-11-12 CN disclosed
EP-1931663-A1 IMDOLIZINE DERIVATIVES AS LIGANDS OF THE CRTH2 RECEPTOR Argenta Discovery Limited (GB) 2008-06-18 EP disclosed
WO-2007031747-A1 IMDOLIZINE DERIVATIVES AS LIGANDS OF THE CRTH2 RECEPTOR ARGENTA DISCOVERY LIMITED (GB) 2007-03-22 WO disclosed
US-4394509-A CHEMICAL INTERMEDIATES FOR SULFOXIDE DERIVATIVES USEFUL AS ANTIULCER AND ANTISECRETORY AGENTS JOHN WYETH AND BROTHER LIMITED (GB) 1983-07-19 US disclosed
US-4327102-A TREATING ULCERS AND HYPERSECRETION JOHN WYETH & BROTHER LIMITED (GB) 1982-04-27 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 (1 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-20080306109-A1 Indolizine Derivatives as Ligands of the Crth2 Receptor HRH4, HRH2, HRH3 RAB9A 2059/4885NPC1 934/4885SMN1; SMN2 4618/4885

“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.