SCHEMBL4610877

SCHEMBL4610877

CCCc1c(C(=O)NCc2ccc(Cl)cc2)n(N)c2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
THRB P10828 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 3/20 0.46
ALDH1A1 P00352 3/20 0.45
RAB9A P51151 2/20 0.45
KDM4E B2RXH2 2/20 0.45
HTT P42858 2/20 0.45
NPC1 O15118 1/20 0.45
GALR3 O60755 1/20 0.45
NR2F2 P24468 1/20 0.45
PTGER4 P35408 2/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL7047164 0.86 CA2 (0.52) KMT2AALDH1A1MAPT
SCHEMBL7039562 0.84 RORC (0.54) ALDH1A1
SCHEMBL4613206 0.80 MEN1 (0.41) KMT2AMEN1SMN1; SMN2LMNAALDH1A1
SCHEMBL7044113 0.80 ALDH1A1 (0.52) KMT2AMEN1SMN1; SMN2LMNAALDH1A1
SCHEMBL4612617 0.79 MEN1 (0.52) KMT2AMEN1ALDH1A1KDM4EHTT
SCHEMBL4611362 0.78 TP53 (0.52) KMT2AMEN1THRBSMN1; SMN2LMNA
SCHEMBL6746550 0.78 NTRK1 (0.41) KMT2AMEN1SMN1; SMN2LMNAALDH1A1
SCHEMBL7046082 0.76 P2RX7 (0.44) KMT2ASMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL7046652 0.76 P2RX7 (0.47) KMT2AMEN1SMN1; SMN2KDM4ENPC1
SCHEMBL6746510 0.76 P2RX7 (0.48) KMT2AMEN1SMN1; SMN2KDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1556034-B1 INDOLE DERIVATIVES AS BETA-2 AGONISTS PFIZER LTD (GB) 2008-04-16 EP claimed
EP-1440966-A1 Indole derivatives useful for the treatment of diseases Pfizer Limited (GB) 2004-07-28 EP claimed
US-20040116503-A1 Indole derivatives useful for the treatment of diseases PFIZER INC. 2004-06-17 US claimed
EP-1556034-B1 INDOLE DERIVATIVES AS BETA-2 AGONISTS PFIZER LTD (GB) 2008-04-16 EP disclosed
EP-1440966-A1 Indole derivatives useful for the treatment of diseases Pfizer Limited (GB) 2004-07-28 EP disclosed