SCHEMBL9537193

SCHEMBL9537193

CCC(=O)N1C/C(=C/N(C)C)C(=O)c2cc(Cl)cc(Cl)c21

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
POLB P06746 1/20 0.31
ALDH1A1 P00352 3/20 0.31
ALDH2 P05091 3/20 0.31
ALDH3A1 P30838 3/20 0.31
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL9537198 1.00 KDM4E (0.32) KDM4EHTTSMN1; SMN2MEN1KMT2A
SCHEMBL9539213 0.81 ADORA3 (0.41) KDM4EHTTSMN1; SMN2MEN1KMT2A
SCHEMBL9539218 0.81 ADORA3 (0.41) KDM4EHTTSMN1; SMN2MEN1KMT2A
SCHEMBL9538368 0.81 KDM4E (0.33) KDM4EHTTSMN1; SMN2MEN1KMT2A
SCHEMBL9538370 0.81 KDM4E (0.33) KDM4EHTTSMN1; SMN2MEN1KMT2A
SCHEMBL9537794 0.74 HSD17B3 (0.33) KDM4EHTTSMN1; SMN2
SCHEMBL9537796 0.74 HSD17B3 (0.33) KDM4EHTTSMN1; SMN2
SCHEMBL9540757 0.73 F10 (0.35) MEN1KMT2APOLBALDH1A1L3MBTL1
SCHEMBL9540761 0.73 F10 (0.35) MEN1KMT2APOLBALDH1A1L3MBTL1
SCHEMBL9537973 0.73 CES1 (0.48) KDM4EHTTSMN1; SMN2MEN1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0180352-B1 BENZENE-FUSED HETEROCYCLIC COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-05-26 EP disclosed
US-4767780-A SUBSTITUTED 1,4-DIHYDRO-(1)-BENZOPYRANO(4,3-C)PYRAZOLES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-08-30 US disclosed
US-4675324-A Substituted pyrazolo [4,3-c]pyridines and their use as uricosuric, diuretic and anti-hypertensive agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-06-23 US disclosed
EP-0180352-A2 Benzene-fused heterocyclic compound FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-05-07 EP disclosed