SCHEMBL11764397

SCHEMBL11764397

Nc1cc2ccccc2[c]c1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.38
ALOX15 P16050 4/20 0.34
TSHR P16473 2/20 0.34
POLB P06746 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
PDPK1 O15530 1/20 0.33
ALDH1A1 P00352 4/20 0.32
HSD17B10 Q99714 4/20 0.32
CYP3A4 P08684 4/20 0.32
HPGD P15428 2/20 0.32
KEAP1 Q14145 1/20 0.32
CYP1A2 P05177 1/20 0.32
PLAU P00749 3/20 0.32
F2 P00734 2/20 0.32
PLG P00747 2/20 0.32
KLK1 P06870 2/20 0.32
PRSS1 P07477 2/20 0.32
PLAT P00750 1/20 0.32
MEN1 O00255 2/20 0.31
USP2 O75604 2/20 0.31

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
SCHEMBL1193247 0.78 TRPM4 (0.41) ALOX15POLBSMN1; SMN2ALDH1A1HSD17B10
SCHEMBL1322927 0.78 TRPM4 (0.41) ALOX15POLBSMN1; SMN2ALDH1A1HSD17B10
SCHEMBL731428 0.78 IDO1 (0.36) IDO1ALOX15TSHRPOLBSMN1; SMN2
SCHEMBL76620 0.75 IDO1 (0.34) IDO1ALOX15TSHRPOLBSMN1; SMN2
SCHEMBL1717201 0.75 BRD4 (0.37) ALOX15ALDH1A1HSD17B10HPGDCYP1A2
SCHEMBL11764391 0.75 TRPM4 (0.39) ALOX15TSHRPDPK1ALDH1A1HSD17B10
SCHEMBL6942856 0.72 BACE1 (0.45) ALDH1A1HSD17B10HPGDMEN1MAPT
SCHEMBL10670045 0.72 BACE1 (0.45) ALDH1A1HSD17B10HPGDMEN1MAPT
SCHEMBL11800563 0.72 IDO1 (0.37) IDO1ALOX15TSHRPOLBSMN1; SMN2
SCHEMBL24252 0.71 CYP2A6 (0.41) ALOX15TSHRPDPK1ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4033945-A Water-soluble trisazo 8-amino-naphthol-1 dyes CASSELLA FARBWERKE MAINKUR AKTIENGESELLSCHAFT (DT) 1977-07-05 US claimed
US-4033945-A Water-soluble trisazo 8-amino-naphthol-1 dyes CASSELLA FARBWERKE MAINKUR AKTIENGESELLSCHAFT (DT) 1977-07-05 US disclosed