SCHEMBL9145698

SCHEMBL9145698

Nc1ccc2c(c1)C(=O)N(Cc1cccnc1)C2=O

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.59
UBE2N P61088 1/20 0.59
ATM Q13315 1/20 0.59
ALDH1A1 P00352 1/20 0.59
TSHR P16473 1/20 0.56
CYP1B1 Q16678 1/20 0.55
GAA P10253 1/20 0.55
POLB P06746 4/20 0.53
MEN1 O00255 1/20 0.51
MAPT P10636 1/20 0.51
MAPK1 P28482 1/20 0.51
HTT P42858 1/20 0.51
RAB9A P51151 1/20 0.51
CCR6 P51684 1/20 0.51
KMT2A Q03164 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51

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
SCHEMBL45682 0.84 KDM4E (0.75) KDM4EUBE2NATMALDH1A1TSHR
SCHEMBL3265430 0.83 CYP1B1 (0.62) KDM4EUBE2NATMALDH1A1TSHR
SCHEMBL18121471 0.82 KDM4E (0.78) KDM4EUBE2NATMALDH1A1TSHR
SCHEMBL10660288 0.82 KMT2A (0.63) ALDH1A1CYP1B1GAAMEN1MAPT
SCHEMBL11013871 0.82 CA1 (0.56) KDM4EUBE2NATMALDH1A1TSHR
SCHEMBL9145775 0.79 KDM4E (0.61) KDM4EUBE2NATMALDH1A1TSHR
SCHEMBL9142852 0.78 ALDH1A1 (0.62) KDM4EUBE2NATMALDH1A1TSHR
SCHEMBL9144515 0.78 ALDH1A1 (0.54) KDM4EUBE2NATMALDH1A1TSHR
SCHEMBL16862969 0.78 KDM4E (0.67) KDM4EUBE2NATMALDH1A1CYP1B1
SCHEMBL22258208 0.77 KDM4E (0.70) KDM4EUBE2NATMALDH1A1TSHR

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
US-5401756-A Benzamide platelet activating factor antagonists MITSUBISHI KASEI CORPORATION (JP) 1995-03-28 US disclosed
US-5304556-A Platelet activating factor antagonists MITSUBISHI KASEI CORPORATION (JP) 1994-04-19 US disclosed
EP-0548934-A1 Benzamide derivatives Mitsubishi Chemical Corporation (JP) 1993-06-30 EP disclosed