SCHEMBL1923652

SCHEMBL1923652

Nc1[nH]c2cc(Cl)ccc2c1C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
KDM4E B2RXH2 1/20 0.54
LMNA P02545 1/20 0.54
CYP2C9 P11712 1/20 0.54
HPGD P15428 1/20 0.54
MAPK1 P28482 1/20 0.54
BLM P54132 1/20 0.54
GRIN2D O15399 1/20 0.53
GRIN3B O60391 1/20 0.53
GRIN1 Q05586 1/20 0.53
GRIN2A Q12879 1/20 0.53
GRIN2B Q13224 1/20 0.53
GRIN2C Q14957 1/20 0.53
GRIN3A Q8TCU5 1/20 0.53
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
GPR17 Q13304 1/20 0.48
NPC1 O15118 1/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL3197903 0.87 CA1 (0.49) MEN1KMT2AKDM4ELMNACYP2C9
SCHEMBL614551 0.80 LMNA (0.54) MEN1KMT2AKDM4ELMNACYP2C9
SCHEMBL9248550 0.80 MEN1 (0.57) MEN1KMT2AKDM4ELMNACYP2C9
SCHEMBL3896042 0.78 ALOX15 (0.67) ALOX15
SCHEMBL4333071 0.77 GPR17 (0.58) MEN1KMT2AKDM4ELMNACYP2C9
SCHEMBL28207427 0.76 KDM4E (0.50) MEN1KMT2AKDM4ELMNACYP2C9
SCHEMBL6218634 0.76 PIN1 (0.48)
SCHEMBL349187 0.75 PARP1 (0.49) KMT2AKDM4EHPGDPARP1
SCHEMBL9690283 0.75 KDM4E (0.62) MEN1KMT2AKDM4ELMNAHPGD
SCHEMBL8139112 0.74 MEN1 (0.70) MEN1KMT2AGRIN2DGRIN3BGRIN1

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
EP-1874777-B1 1H-PYRIMIDO[4,5-B]INDOLE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE SANOFI AVENTIS (FR) 2011-06-08 EP disclosed