SCHEMBL7522262

SCHEMBL7522262

NC(=O)c1cccc(-n2c(=O)cc[nH]c2=O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 7/20 0.48
PARP15 Q460N3 1/20 0.48
PARP10 Q53GL7 1/20 0.48
BRD4 O60885 1/20 0.42
PLA2G10 O15496 1/20 0.42
PIK3R2 O00459 1/20 0.41
CCNT1 O60563 1/20 0.41
CCND1 P24385 1/20 0.41
CCNC P24863 1/20 0.41
CDK8 P49336 1/20 0.41
CDK7 P50613 1/20 0.41
CDK9 P50750 1/20 0.41
CCNH P51946 1/20 0.41
MNAT1 P51948 1/20 0.41
CDK6 Q00534 1/20 0.41
PRKCI P41743 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
USP2 O75604 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL7133475 0.76 FAAH (0.46) KDM4EALDH1A1GAAHSD17B10TSHR
SCHEMBL6519756 0.75 ALDH1A1 (0.38) KDM4EMEN1ALDH1A1GAAMAPT
SCHEMBL45000 0.75 GSK3A (0.54) MEN1ALDH1A1GAAMAPTKMT2A
SCHEMBL16720590 0.70 KDM4E (0.74) PARP1PARP15PARP10PLA2G10PIK3R2
SCHEMBL6519759 0.68 MAPT (0.49) KDM4EMEN1USP2ALDH1A1POLB
SCHEMBL9878672 0.68 TDP1 (0.56) KDM4EMEN1ALDH1A1MYCPOLB
SCHEMBL31021028 0.68 PARP1 (0.73) PARP1PARP15PARP10MEN1POLB
SCHEMBL36694 0.68 PARP1 (0.73) PARP1PARP15PARP10MEN1POLB
SCHEMBL10515423 0.67 PARP1 (0.65) PARP1PARP15PARP10MEN1ALDH1A1
SCHEMBL29510746 0.67 PARP1 (0.65) PARP1PARP15PARP10MEN1ALDH1A1

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-0770067-B1 SUBSTITUTED CINNAMIC OXIME AND HYDROXAMIDE DERIVATIVES BASF AG (DE) 2002-03-13 EP disclosed
US-6013606-A HERBICIDES BASF AKTEINGESELLSCHAFT (DE) 2000-01-11 US disclosed
CN-1156452-A Substituted cinnamic hydroxamic and cinnamic hydroxyamide derivatives BASF AG (DE) 1997-08-06 CN disclosed