SCHEMBL9307980

SCHEMBL9307980

O=C(O)c1ccncc1C(c1ccccc1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 15/20 0.56
ALDH1A1 P00352 2/20 0.51
KMT2A Q03164 2/20 0.51
TDP1 Q9NUW8 2/20 0.51
GAA P10253 1/20 0.51
KDM6B O15054 9/20 0.49
KDM4D Q6B0I6 6/20 0.49
KDM4E B2RXH2 2/20 0.49
KDM4A O75164 2/20 0.49
MEN1 O00255 1/20 0.49
MAPT P10636 1/20 0.49
THRB P10828 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
SLC6A2 P23975 2/20 0.47
SLC6A4 P31645 2/20 0.47
SLC6A3 Q01959 2/20 0.47
CFTR P13569 1/20 0.47
GOPC Q9HD26 1/20 0.47
EGLN3 Q9H6Z9 1/20 0.41
KDM5B Q9UGL1 1/20 0.41

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
SCHEMBL21056807 0.83 KDM4C (0.58) KDM4CALDH1A1KMT2ATDP1KDM6B
SCHEMBL9305621 0.83 KDM4E (0.53) KDM4CALDH1A1KMT2ATDP1GAA
SCHEMBL9042891 0.82 LMNA (0.45) KDM4CALDH1A1KMT2ATDP1GAA
SCHEMBL28704416 0.81 KDM4C (0.51) KDM4CALDH1A1KMT2ATDP1KDM6B
SCHEMBL30772293 0.79 KDM4E (0.49) KDM4CALDH1A1KMT2ATDP1GAA
SCHEMBL8945914 0.77 ALDH1A1 (0.79) ALDH1A1KMT2ATDP1GAAKDM4E
SCHEMBL29248918 0.77 ALDH1A1 (0.45) KDM4CALDH1A1KMT2ATDP1GAA
SCHEMBL17294252 0.77 KDM4C (0.53) KDM4CALDH1A1KMT2ATDP1GAA
SCHEMBL17465921 0.77 KDM4C (0.53) KDM4CALDH1A1KMT2ATDP1GAA
SCHEMBL29219093 0.74 KDM4C (0.50) KDM4CALDH1A1KMT2ATDP1KDM6B

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-5369084-A Isonicotinic acid derivatives and related spiro compounds with herbicidal action JANSSEN PHARMACEUTICAL N.V. (BE) 1994-11-29 US disclosed
EP-0558521-A1 ISONICOTINIC ACID DERIVATIVES AND RELATED SPIRO COMPOUNDS WITH HERBICIDAL ACTION JANSSEN PHARMACEUTICA N.V. (BE) 1993-09-08 EP disclosed
WO-1992009577-A1 ISONICOTINIC ACID DERIVATIVES AND RELATED SPIRO COMPOUNDS WITH HERBICIDAL ACTION JANSSEN PHARMACEUTICA N.V. (BE) 1992-06-11 WO disclosed