SCHEMBL21533064

SCHEMBL21533064

CCc1cc(-c2cccc(C#N)c2Cl)ccc1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 2/20 0.38
▸ TSHR P16473 1/20 0.35
▸ XDH P47989 1/20 0.35
▸ CYP11B2 P19099 1/20 0.35
▸ NPSR1 Q6W5P4 2/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ HPGD P15428 2/20 0.34
▸ DGAT1 O75907 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ ADORA2A P29274 2/20 0.34
▸ GRIA1 P42261 1/20 0.33
▸ CACNG8 Q8WXS5 1/20 0.33
▸ DHODH Q02127 1/20 0.33
▸ ESR2 Q92731 1/20 0.33

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
SCHEMBL7103488 0.73 XDH (0.43) ARTSHRXDH
SCHEMBL28022369 0.70 ESR2 (0.48) ARTSHRNPSR1KDM4EALDH1A1
SCHEMBL6562393 0.70 ESR2 (0.50) ARTSHRCYP11B2NPSR1KDM4E
SCHEMBL29662920 0.70 ESR2 (0.50) ARTSHRCYP11B2NPSR1KDM4E
SCHEMBL18190520 0.69 GRIA1 (0.67) DGAT1GRIA1CACNG8ESR2
SCHEMBL21533143 0.69 AR (0.40) ARTSHRALDH1A1CYP1A2CYP2C9
SCHEMBL14040913 0.69 ESR2 (0.54) CYP1A2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL30550569 0.69 ESR2 (0.44) ARCYP11B2KDM4EALDH1A1HPGD
SCHEMBL9630722 0.69 HSD17B1 (0.42) TSHRALDH1A1HPGDMEN1KMT2A
SCHEMBL21973781 0.69 DHODH (0.38) ARCYP11B2KDM4EALDH1A1HPGD

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
EP-3288935-B1 INDOLONE COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2019-10-30 — — EP disclosed
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