SCHEMBL11265258

SCHEMBL11265258

Cn1c(C(=O)O)nc2cc(C(=O)c3ccccc3)ccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.55
SMN1; SMN2 Q16637 6/20 0.55
GLA P06280 1/20 0.55
HPGD P15428 5/20 0.50
HDAC6 Q9UBN7 7/20 0.48
HDAC1 Q13547 2/20 0.47
HDAC8 Q9BY41 1/20 0.47
RECQL P46063 3/20 0.47
HSD17B10 Q99714 1/20 0.47
RAB9A P51151 4/20 0.45
MAPT P10636 3/20 0.45
NPC1 O15118 2/20 0.45
TP53 P04637 2/20 0.45
LMNA P02545 2/20 0.45
HTT P42858 1/20 0.45
POLB P06746 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.45
USP2 O75604 1/20 0.45
BLM P54132 1/20 0.45

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
SCHEMBL11266333 0.84 SMN1; SMN2 (0.51) SMN1; SMN2HPGDHDAC6HDAC1HDAC8
SCHEMBL5461482 0.83 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2GLAHPGDHDAC6
SCHEMBL11276434 0.81 HDAC6 (0.54) ALDH1A1SMN1; SMN2GLAHPGDHDAC6
SCHEMBL760729 0.78 SMN1; SMN2 (0.57) ALDH1A1SMN1; SMN2HPGDHDAC6RECQL
SCHEMBL11272498 0.78 HPGD (0.46) SMN1; SMN2HPGDHDAC6HDAC1HDAC8
SCHEMBL19034792 0.78 HCAR3 (0.53) SMN1; SMN2HPGDHDAC6HDAC1HDAC8
SCHEMBL14220982 0.76 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2GLAHPGDHDAC6
SCHEMBL28871141 0.76 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2GLAHPGDHDAC6
Hydrochloric Acid SCHEMBL9663652 0.74 HSD17B10 (0.53) ALDH1A1SMN1; SMN2GLAHPGDHDAC6
SCHEMBL8471293 0.73 KDM4E (0.68) ALDH1A1SMN1; SMN2GLAHPGDRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4344957-A Benz-acyl-benzimidazole derivatives and antiallergic compositions CIBA-GEIGY CORPORATION (US) 1982-08-17 US disclosed
US-4213993-A ANTIALLERGENS CIBA-GEIGY CORPORATION (US) 1980-07-22 US disclosed
US-4141982-A ANTIALLERGENS CIBA-GEIGY CORPORATION (US) 1979-02-27 US disclosed