SCHEMBL9011545

SCHEMBL9011545

NC(=O)c1cccc2ccccc12.[LiH]

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.66
GAA P10253 2/20 0.66
ALDH1A1 P00352 2/20 0.66
NR4A1 P22736 1/20 0.63
NR4A2 P43354 1/20 0.63
NR4A3 Q92570 1/20 0.63
POLB P06746 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
MMP3 P08254 1/20 0.57
HDAC8 Q9BY41 1/20 0.57
PTPN1 P18031 1/20 0.55
CDC25B P30305 1/20 0.55
PLK1 P53350 1/20 0.55
KMT2A Q03164 3/20 0.54
MEN1 O00255 1/20 0.54
ATM Q13315 1/20 0.52
HPGD P15428 2/20 0.50
MAPT P10636 1/20 0.50
TSHR P16473 1/20 0.50
HSD17B10 Q99714 1/20 0.50

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
SCHEMBL43084 0.98 KDM4E (0.68) KDM4EGAAALDH1A1NR4A1NR4A2
SCHEMBL29381201 0.98 KDM4E (0.68) KDM4EGAAALDH1A1NR4A1NR4A2
SCHEMBL14837757 0.96 KDM4E (0.66) KDM4EGAAALDH1A1NR4A1NR4A2
SCHEMBL29070800 0.96 KDM4E (0.66) KDM4EGAAALDH1A1NR4A1NR4A2
Potassium SCHEMBL29689182 0.96 KDM4E (0.66) KDM4EGAAALDH1A1NR4A1NR4A2
SCHEMBL18859030 0.96 KDM4E (0.66) KDM4EGAAALDH1A1NR4A1NR4A2
Hydrochloric Acid SCHEMBL3149083 0.96 KDM4E (0.66) KDM4EGAAALDH1A1NR4A1NR4A2
SCHEMBL18859029 0.96 KDM4E (0.66) KDM4EGAAALDH1A1NR4A1NR4A2
Hydrochloric Acid SCHEMBL29605461 0.96 KDM4E (0.66) KDM4EGAAALDH1A1NR4A1NR4A2
Ammonia Solution, Strong SCHEMBL1553414 0.96 KDM4E (0.66) KDM4EGAAALDH1A1NR4A1NR4A2

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
US-5498736-A 2,5-reactive substituent group-containing siloles, silole polycondensates and preparation thereof SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-03-12 US disclosed