SCHEMBL10690737

SCHEMBL10690737

COc1ccc(C(=O)Nc2nnn[nH]2)c(OC(C)C)c1[Si](C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 5/20 0.36
HIF1A Q16665 1/20 0.36
ALDH1A1 P00352 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
POLB P06746 2/20 0.35
ALPL P05186 2/20 0.35
PDE4A P27815 4/20 0.35
PDE4B Q07343 4/20 0.35
PDE4C Q08493 4/20 0.35
NPC1 O15118 4/20 0.34
RAB9A P51151 4/20 0.34
KCNMA1 Q12791 1/20 0.34
CASP3 P42574 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
MAPK1 P28482 3/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
ALPI P09923 1/20 0.34

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
SCHEMBL10693184 0.87 PDE4D (0.36) PDE4DALDH1A1MEN1KMT2APOLB
SCHEMBL10690904 0.87 PDE4D (0.36) PDE4DHIF1AALDH1A1MEN1KMT2A
SCHEMBL9501827 0.82 POLB (0.40) PDE4DALDH1A1MEN1KMT2APOLB
SCHEMBL9501851 0.78 MPO (0.48) ALDH1A1MEN1KMT2AALPLNPC1
SCHEMBL10690439 0.78 NPC1 (0.47) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL9501844 0.77 PLG (0.43) ALDH1A1MEN1KMT2AALPLNPC1
SCHEMBL9501813 0.77 HTT (0.45) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL9501510 0.76 MPO (0.41) ALDH1A1ALPLNPC1RAB9AMAPK1
SCHEMBL10690935 0.76 ALDH1A1 (0.38) PDE4DALDH1A1MEN1KMT2APOLB
SCHEMBL11110352 0.76 POLB (0.57) ALDH1A1MEN1KMT2APOLBNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4764525-A N-1H-tetrazol-5-ylbenzamides having use as antiallergy and antiinflammatory agents WARNER-LAMBERT COMPANY (US) 1988-08-16 US disclosed