SCHEMBL7760288

SCHEMBL7760288

O=C(Nc1ccccc1)c1cc(Cl)cc(-c2ccccc2)c1OCl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.55
CHRNB4 P30926 1/20 0.55
CHRNA3 P32297 1/20 0.55
CHRNA4 P43681 1/20 0.55
TMPRSS4 Q9NRS4 1/20 0.54
STK39 Q9UEW8 2/20 0.51
SMO Q99835 2/20 0.50
GAA P10253 2/20 0.49
POLB P06746 1/20 0.49
TP53 P04637 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
RAB9A P51151 1/20 0.48
KDM4E B2RXH2 2/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HTT P42858 3/20 0.46
ALDH1A1 P00352 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CNR1 P21554 1/20 0.46

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
SCHEMBL7761587 0.79 GPR27 (0.47) CHRNB2CHRNB4CHRNA3CHRNA4TMPRSS4
SCHEMBL8469626 0.78 CHRNB2 (0.48) CHRNB2CHRNB4CHRNA3CHRNA4TMPRSS4
SCHEMBL649648 0.77 PPARG (0.49) TMPRSS4STK39SMOTP53MEN1
SCHEMBL15568158 0.76 PPARG (0.48) TMPRSS4STK39SMOTP53MEN1
Potassium SCHEMBL15568160 0.76 PPARG (0.48) TMPRSS4STK39SMOTP53MEN1
SCHEMBL574119 0.75 P2RX1 (0.59) STK39MEN1KMT2ARAB9AKDM4E
SCHEMBL8460416 0.75 AURKA (0.47) TMPRSS4STK39SMOTP53MEN1
SCHEMBL8469266 0.74 SMO (0.56) SMOTP53MEN1KMT2ARAB9A
SCHEMBL28017780 0.72 SMO (0.55) SMOTP53MEN1KMT2ARAB9A
SCHEMBL1648370 0.72 GPR27 (0.53) TMPRSS4SMOTP53MEN1KMT2A

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-2001070189-A1 METHOD AND COMPOSITION FOR SKIN LIGHTENING APPLYING CARBOXYLIC ACIDS UNILEVER PLC (GB) 2001-09-27 WO disclosed