SCHEMBL11734966

SCHEMBL11734966

O=C(Nc1nnn[nH]1)c1cnc2sc3ccc(Cl)cc3n2c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.44
▸ LMNA P02545 2/20 0.38
▸ HSD17B10 Q99714 6/20 0.37
▸ HPGD P15428 4/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ HTT P42858 1/20 0.37
▸ RXFP1 Q9HBX9 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ KMT2A Q03164 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ ALPL P05186 1/20 0.36
▸ KDM4E B2RXH2 5/20 0.36
▸ NPC1 O15118 4/20 0.36
▸ RAB9A P51151 4/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.36
▸ TSHR P16473 1/20 0.36
▸ MAPT P10636 1/20 0.35
▸ POLB P06746 2/20 0.35
▸ GLA P06280 1/20 0.32

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
SCHEMBL11735893 0.92 SMN1; SMN2 (0.50) SMN1; SMN2LMNAHSD17B10HPGDALDH1A1
SCHEMBL11733170 0.89 TP53 (0.37) SMN1; SMN2LMNAHSD17B10HPGDALDH1A1
SCHEMBL11740117 0.88 TP53 (0.39) SMN1; SMN2LMNAHSD17B10HPGDALDH1A1
SCHEMBL11729010 0.88 KDM4E (0.43) SMN1; SMN2LMNAHSD17B10HPGDALDH1A1
SCHEMBL11736358 0.88 KDM4E (0.41) SMN1; SMN2LMNAHSD17B10HPGDALDH1A1
SCHEMBL11730627 0.88 SMN1; SMN2 (0.41) SMN1; SMN2LMNAHSD17B10HPGDALDH1A1
SCHEMBL11736073 0.87 ALDH1A1 (0.38) SMN1; SMN2LMNAHSD17B10HPGDALDH1A1
SCHEMBL10993418 0.86 MAPT (0.41) SMN1; SMN2LMNAHSD17B10HPGDALDH1A1
SCHEMBL11735667 0.86 SMN1; SMN2 (0.43) SMN1; SMN2HSD17B10HPGDALDH1A1TP53
SCHEMBL11733914 0.86 TP53 (0.49) SMN1; SMN2LMNAHSD17B10HPGDALDH1A1

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-4041163-A N-(5-Tetrazolyl)-4-oxo-4H-pyrimido(2,1-b)benzothiazole-3-carboxamide antiallergy agents PFIZER INC. (US) 1977-08-09 — — US disclosed
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