SCHEMBL7576190

SCHEMBL7576190

OCCc1ccn[c]c1-c1ccccc1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.38
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.36
BCL2L1 Q07817 1/20 0.36
HSD17B10 Q99714 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.34
HTR2B P41595 5/20 0.33
HTR2C P28335 2/20 0.33
CCNB2 O95067 1/20 0.32
CDK1 P06493 1/20 0.32
CCNB1 P14635 1/20 0.32
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
CDK5 Q00535 1/20 0.32
CDK5R1 Q15078 1/20 0.32
CCNB3 Q8WWL7 1/20 0.32
TSHR P16473 2/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 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
SCHEMBL7576499 0.82 IKBKB (0.34) IDO1SMN1; SMN2
SCHEMBL8473218 0.76 HPGD (0.53) IDO1ALDH1A1HPGDBCL2L1HSD17B10
SCHEMBL7570634 0.73 SMN1; SMN2 (0.40) IDO1ALDH1A1HPGDBCL2L1HSD17B10
SCHEMBL7572110 0.69 KDM1A (0.40) ALDH1A1HPGDHSD17B10SMN1; SMN2CCNB2
SCHEMBL1594956 0.67 TDP1 (0.42) ALDH1A1BCL2L1SMN1; SMN2TSHRTAAR1
SCHEMBL43837 0.65 TAAR1 (0.62) IDO1TSHRTAAR1
SCHEMBL29646276 0.65 TAAR1 (0.62) IDO1TSHRTAAR1
SCHEMBL28308651 0.65 TAAR1 (0.62) IDO1TSHRTAAR1
SCHEMBL3763076 0.65 PDCD1 (0.38) ALDH1A1HPGDHSD17B10TSHRKDM4E
Ethylene Glycol SCHEMBL7109461 0.64 ALDH1A1 (0.62) IDO1ALDH1A1HPGDBCL2L1HSD17B10

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
WO-2002089799-A2 USE OF DIHYDROPYRAZOLES TO INCREASE ERYTHROPOIETIN AND VASCULARI ZATION THE PROCTER & GAMBLE COMPANY (US) 2002-11-14 WO disclosed