SCHEMBL6164950

SCHEMBL6164950

Cc1ccc(C(=O)OCC[Si](C)(C)C)c(N)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.43
HSD17B10 Q99714 7/20 0.43
KDM4E B2RXH2 4/20 0.40
POLB P06746 1/20 0.40
HPGD P15428 3/20 0.40
GLA P06280 2/20 0.40
GAA P10253 2/20 0.40
MAPT P10636 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
ATM Q13315 1/20 0.40
RAB9A P51151 4/20 0.39
NPC1 O15118 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
MAPK1 P28482 2/20 0.39
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
HIF1A Q16665 1/20 0.39

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
SCHEMBL9744466 0.84 ALDH1A1 (0.41) ALDH1A1HSD17B10KDM4EPOLBHPGD
SCHEMBL3687067 0.81 ALDH1A1 (0.64) ALDH1A1HSD17B10KDM4EHPGDGLA
SCHEMBL10592626 0.79 ALDH1A1 (0.43) ALDH1A1HSD17B10KDM4EPOLBHPGD
SCHEMBL6215461 0.79 NPC1 (0.41) ALDH1A1KDM4EGAAMAPTATM
SCHEMBL25037576 0.77 KDM4E (0.59) ALDH1A1KDM4EGLASMN1; SMN2CYP3A4
SCHEMBL12552829 0.77 ALDH1A1 (0.40) ALDH1A1KDM4EPOLBHPGDGAA
SCHEMBL6756725 0.76 ALDH1A1 (0.56) ALDH1A1HSD17B10KDM4EPOLBHPGD
SCHEMBL27316368 0.76 ALDH1A1 (0.47) ALDH1A1HSD17B10KDM4EHPGDGLA
SCHEMBL6166866 0.75 KDM4E (0.44) ALDH1A1HSD17B10KDM4EPOLBHPGD
SCHEMBL9533684 0.75 CYP46A1 (0.49) ALDH1A1KDM4EHPGDGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1379516-B1 ALKOXYCARBONYLAMINO BENZOIC ACID OR ALKOXYCARBONYLAMINO TETRAZOLYL PHENYL DERIVATIVES AS IP ANTAGONISTS HOFFMANN LA ROCHE (CH) 2005-11-16 EP disclosed
US-6903086-B2 Alkoxycarbonylamino benzoic acid or alkoxycarbonylamino tetrazolyl phenyl derivatives as IP antagonists SYNTEX (U.S.A.) LLC (US) 2005-06-07 US disclosed
EP-1379516-A1 ALKOXYCARBONYLAMINO BENZOIC ACID OR ALKOXYCARBONYLAMINO TETRAZOLYL PHENYL DERIVATIVES AS IP ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2004-01-14 EP disclosed
US-20020165235-A1 Alkoxycarbonylamino benzoic acid or alkoxycarbonylamino tetrazolyl phenyl derivatives as IP antagonists SYNTEX (U.S.A.) LLC 2002-11-07 US disclosed
WO-2002070500-A1 ALKOXYCARBONYLAMINO BENZOIC ACID OR ALKOXYCARBONYLAMINO TETRAZOLYL PHENYL DERIVATIVES AS IP ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2002-09-12 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 (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-20020165235-A1 Alkoxycarbonylamino benzoic acid or alkoxycarbonylamino tetrazolyl phenyl derivatives as IP antagonists GPBAR1, GABRP, TBXA2R ALDH1A1 1042/4885HSD17B10 1973/4885KDM4E 4590/4885

“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.