SCHEMBL3667518

SCHEMBL3667518

Cc1nc2ccccc2n1-c1ccc(C(=O)O)cc1

nearest known ligand 0.72

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.72
MAPK1 P28482 2/20 0.71
HTT P42858 2/20 0.71
SMN1; SMN2 Q16637 1/20 0.60
HRH3 Q9Y5N1 11/20 0.55
THRB P10828 1/20 0.54
POLB P06746 1/20 0.53
RECQL P46063 1/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
HPGD P15428 1/20 0.52
KCNH2 Q12809 2/20 0.52

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
SCHEMBL18355573 0.88 MAPK1 (0.66) HSD17B10MAPK1HTTSMN1; SMN2HRH3
SCHEMBL14000496 0.87 MAPK1 (0.64) HSD17B10MAPK1HTTHRH3KCNH2
SCHEMBL7762886 0.85 HSD17B10 (0.72) HSD17B10MAPK1HTTSMN1; SMN2THRB
SCHEMBL14000477 0.84 MAPK1 (0.60) HSD17B10MAPK1HTTHRH3POLB
SCHEMBL3724649 0.84 POLB (0.70) HSD17B10MAPK1HTTHRH3POLB
SCHEMBL23874011 0.84 ESR1 (0.67) HSD17B10MAPK1HTTRECQLKDM4E
SCHEMBL120600 0.84 HSD17B10 (1.00) HSD17B10MAPK1HTTSMN1; SMN2THRB
SCHEMBL13666576 0.84 HSD17B10 (0.79) HSD17B10MAPK1HTTSMN1; SMN2THRB
SCHEMBL29784251 0.84 HSD17B10 (1.00) HSD17B10MAPK1HTTSMN1; SMN2THRB
SCHEMBL540947 0.84 MAPK1 (1.00) HSD17B10MAPK1HTTSMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109735242-B Easy-to-tear woven adhesive tape and preparation method thereof 宁波三同编织有限公司 2021-02-12 CN claimed
CN-109735242-B Easy-to-tear woven adhesive tape and preparation method thereof 宁波三同编织有限公司 2021-02-12 CN disclosed
US-7935719-B2 N-substituted-azacyclylamines as histamine-3 antagonists WYETH LLC (US) 2011-05-03 US disclosed
US-7935719-B2 N-substituted-azacyclylamines as histamine-3 antagonists WYETH LLC (US) 2011-05-03 US disclosed
EP-2155719-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS Wyeth LLC (US) 2010-02-24 EP disclosed
WO-2008147945-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2008-12-04 WO disclosed
WO-2008147945-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2008-12-04 WO disclosed
US-20080293771-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2008-11-27 US disclosed
US-20080293771-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2008-11-27 US disclosed
US-20080293771-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2008-11-27 US disclosed
US-20080119458-A1 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2008-05-22 US disclosed
US-20080119458-A1 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2008-05-22 US disclosed
WO-2008045371-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2008-04-17 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 (2 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-20080119458-A1 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS HNMT, HRH4, HRH3 HSD17B10 3575/4885MAPK1 2641/4885HTT 378/4885
US-20080293771-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS HRH4, HRH3, HRH2 HSD17B10 2810/4885MAPK1 3167/4885HTT 867/4885

“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.