SCHEMBL9868029

SCHEMBL9868029

Cc1c(Cl)cc(C(=O)Nc2ccccc2)c(O)c1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPD1 P10809 1/20 0.55
HSPE1 P61604 1/20 0.55
DHODH Q02127 1/20 0.54
MEN1 O00255 5/20 0.53
KMT2A Q03164 5/20 0.53
TMPRSS4 Q9NRS4 1/20 0.52
BCL2 P10415 2/20 0.52
HPGD P15428 3/20 0.51
GPR27 Q9NS67 3/20 0.50
STK39 Q9UEW8 1/20 0.50
LMNA P02545 2/20 0.49
TP53 P04637 2/20 0.49
KDM4E B2RXH2 1/20 0.49
HTT P42858 1/20 0.49
HSD17B10 Q99714 1/20 0.49
BDKRB1 P46663 1/20 0.47
MAPT P10636 2/20 0.47
MAPK1 P28482 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
RAB9A P51151 2/20 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
SCHEMBL2296409 0.86 TMPRSS4 (0.56) HSPD1HSPE1DHODHMEN1KMT2A
SCHEMBL13656899 0.79 MEN1 (0.66) HSPD1HSPE1DHODHMEN1KMT2A
SCHEMBL28091035 0.78 GPR27 (0.57) MEN1KMT2ATMPRSS4BCL2HPGD
SCHEMBL4359810 0.78 MEN1 (0.56) MEN1KMT2ALMNATP53KDM4E
SCHEMBL9865757 0.78 MEN1 (0.59) HSPD1HSPE1MEN1KMT2ATMPRSS4
SCHEMBL9868077 0.77 STK39 (0.77) TMPRSS4STK39MAPK1
SCHEMBL27733378 0.77 HTT (0.56) HSPD1HSPE1MEN1KMT2ATMPRSS4
SCHEMBL8009293 0.76 PPARG (0.58) MEN1KMT2ATMPRSS4HPGDGPR27
Hydrochloric Acid SCHEMBL11777767 0.76 STK39 (0.75) TMPRSS4STK39MAPK1
SCHEMBL2149302 0.76 AKR1C2 (0.52) MEN1KMT2AHPGDTP53KDM4E

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-0412211-A1 Cancer therapy system THERAPEUTICAL SYSTEMS CORPORATION (US) 1991-02-13 EP disclosed