SCHEMBL7434700

SCHEMBL7434700

CCOC(=O)c1c[nH]c(C)c(-c2ccccc2)c1=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLEC4M Q9H2X3 1/20 0.54
GABRA1 P14867 3/20 0.52
GABRB2 P47870 3/20 0.52
MDM2 Q00987 3/20 0.52
GABRB1 P18505 2/20 0.52
GABRA3 P34903 2/20 0.52
JAK2 O60674 2/20 0.51
JAK3 P52333 2/20 0.51
TSHR P16473 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
KDM4E B2RXH2 2/20 0.49
MAPT P10636 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
NPC1 O15118 1/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
GAA P10253 1/20 0.49
HPGD P15428 1/20 0.49
RAB9A P51151 1/20 0.49

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
SCHEMBL7433705 0.86 GABRA1 (0.58) CLEC4MGABRA1GABRB2GABRB1GABRA3
SCHEMBL2658810 0.86 TP53 (0.50) CLEC4MGABRA1GABRB2MDM2GABRB1
SCHEMBL2658550 0.86 CLEC4M (0.52) CLEC4MGABRA1GABRB2MDM2GABRB1
SCHEMBL1559220 0.86 CLEC4M (0.49) CLEC4MGABRA1GABRB2GABRB1GABRA3
SCHEMBL2658889 0.85 JAK2 (0.54) CLEC4MGABRA1GABRB2GABRB1GABRA3
SCHEMBL2657032 0.85 CLEC4M (0.51) CLEC4MGABRA1GABRB2MDM2GABRB1
SCHEMBL2658905 0.84 KDM4E (0.55) CLEC4MGABRA1GABRB2GABRB1GABRA3
SCHEMBL2656845 0.83 CLEC4M (0.46) CLEC4MGABRA1GABRB2GABRB1GABRA3
SCHEMBL7439474 0.82 AR (0.60) CLEC4MGABRA1GABRB2MEN1KMT2A
SCHEMBL10462527 0.82 CSNK2A1 (0.47) KDM4EMAPTALDH1A1LMNAHPGD

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
US-6333336-B1 GAMMA-AMINOBUTYRIC ACID RECEPTORS AS ANTICONVULSANTS FORMING THE COMPOUND BY AMIDATION MERCK SHARP & DOHME LTD. (GB) 2001-12-25 US disclosed
US-4964896-A GAMETOCIDES MONSANTO COMPANY (US) 1990-10-23 US disclosed
US-4936904-A Aryl-4-oxonicotinates useful for inducing male sterility in cereal grain plants MONSANTO TECHNOLOGY LLC 1990-06-26 US disclosed
US-4714492-A HYBRIDIZATION AGENTS ROHM AND HAAS COMPANY (US) 1987-12-22 US disclosed