SCHEMBL9538285

SCHEMBL9538285

CCNC(=O)N1C/C(=C/N(C)C)C(=O)c2cc(Cl)ccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.36
MEN1 O00255 1/20 0.36
DPP4 P27487 1/20 0.35
PDE4A P27815 1/20 0.35
PTGER1 P34995 1/20 0.35
LMNA P02545 1/20 0.34
AVPR2 P30518 1/20 0.34
SLC6A15 Q9H2J7 1/20 0.34
GABRA1 P14867 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA5 P31644 1/20 0.34
GABRA3 P34903 1/20 0.34
GABRA2 P47869 1/20 0.34
GABRA6 Q16445 1/20 0.34
HSD17B3 P37058 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
NOTUM Q6P988 1/20 0.33
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL9538292 1.00 KMT2A (0.36) KMT2AMEN1DPP4PDE4APTGER1
SCHEMBL9539218 0.85 ADORA3 (0.41) KMT2AMEN1GABRA1GABRG2GABRB3
SCHEMBL9539213 0.85 ADORA3 (0.41) KMT2AMEN1GABRA1GABRG2GABRB3
SCHEMBL9539418 0.83 ADORA3 (0.42) KMT2AMEN1LMNAGABRA1GABRG2
SCHEMBL9539420 0.83 ADORA3 (0.42) KMT2AMEN1LMNAGABRA1GABRG2
SCHEMBL9539428 0.81 GABRA1 (0.33) KMT2AMEN1GABRA1GABRG2GABRB3
SCHEMBL9539432 0.81 GABRA1 (0.33) KMT2AMEN1GABRA1GABRG2GABRB3
SCHEMBL9538869 0.80 DRD2 (0.41) SLC6A15GABRA1GABRG2GABRB3GABRA5
SCHEMBL9538873 0.80 DRD2 (0.41) SLC6A15GABRA1GABRG2GABRB3GABRA5
SCHEMBL9539134 0.80 CNR1 (0.37) KMT2AMEN1HSD17B3NOTUMKDM4E

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