SCHEMBL7803015

SCHEMBL7803015

CC(O)c1cc2ccccc2n1Cc1cccnc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.48
IDO1 P14902 1/20 0.47
ALOX5AP P20292 1/20 0.47
LMNA P02545 2/20 0.45
CCR2 P41597 1/20 0.44
GABRA1 P14867 3/20 0.43
GABRA5 P31644 3/20 0.43
TSHR P16473 1/20 0.42
NTRK1 P04629 1/20 0.41
NOX4 Q9NPH5 1/20 0.41
BRD4 O60885 1/20 0.40
CNR2 P34972 1/20 0.40
CYP11B2 P19099 2/20 0.40
GUSB P08236 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP11B1 P15538 1/20 0.39

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
SCHEMBL7811906 0.86 IDO1 (0.47) SRCIDO1ALOX5APLMNACCR2
SCHEMBL7803252 0.81 IDO1 (0.45) SRCIDO1ALOX5APLMNACCR2
SCHEMBL27204175 0.80 BRD4 (0.56) SRCIDO1ALOX5APLMNAGABRA1
SCHEMBL18258220 0.78 ALDH1A1 (0.51) SRCIDO1ALOX5APLMNACCR2
SCHEMBL7423858 0.78 CCR2 (0.74) SRCIDO1LMNACCR2GABRA1
SCHEMBL20853252 0.76 SRC (0.47) SRCIDO1ALOX5APLMNACCR2
SCHEMBL7812252 0.75 IDO1 (0.51) SRCIDO1ALOX5APLMNACCR2
SCHEMBL7807930 0.74 IDO1 (0.41) IDO1ALOX5APLMNACCR2GABRA1
SCHEMBL18247693 0.74 GABRA5 (0.48) SRCIDO1ALOX5APLMNACCR2
SCHEMBL30229394 0.74 GABRA5 (0.48) SRCIDO1ALOX5APLMNACCR2

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
EP-0949259-B1 N-HYDROXYUREA DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME NIKKEN CHEMICALS CO LTD (JP) 2001-06-20 EP disclosed
US-6184238-B1 ANTIALLERGENS, ANTIINFLAMMATORY AGENTS NIKKEN CHEMICALS CO., LTD. (JP) 2001-02-06 US disclosed
EP-0949259-A1 N-HYDROXYUREA DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME Nikken Chemicals Company, Limited (JP) 1999-10-13 EP disclosed