SCHEMBL11863032

SCHEMBL11863032

CC(C)N(CCNC(=O)c1nn(-c2ccccc2)c2c1CCc1cc(Cl)ccc1-2)C(C)C

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ RAD52 P43351 1/20 0.62
▸ CNR2 P34972 10/20 0.47
▸ CNR1 P21554 3/20 0.47
▸ KDM5B Q9UGL1 1/20 0.46

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
SCHEMBL11867074 0.90 RAD52 (0.62) RAD52CNR2CNR1
SCHEMBL11859430 0.88 RAD52 (0.75) RAD52CNR2CNR1
Hydrochloric Acid SCHEMBL11854978 0.88 RAD52 (0.74) RAD52CNR2CNR1
Iodomethane SCHEMBL11870131 0.87 RAD52 (0.73) RAD52CNR2CNR1
SCHEMBL11860266 0.86 RAD52 (0.58) RAD52CNR2CNR1
SCHEMBL11859404 0.83 RAD52 (0.54) RAD52CNR2CNR1KDM5B
SCHEMBL11870710 0.82 CNR2 (0.54) RAD52CNR2CNR1
SCHEMBL11858506 0.81 CNR2 (0.56) RAD52CNR2CNR1
Hydrochloric Acid SCHEMBL11863213 0.80 RAD52 (0.51) RAD52CNR2CNR1
Hydrochloric Acid SCHEMBL11863224 0.80 RAD52 (0.51) RAD52CNR2CNR1

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
US-3940418-A Esters and amides of 4,5-dihydrobenz[g]indazole-3-carboxylic acids and related compounds G. D. SEARLE & CO. (US) 1976-02-24 — — US disclosed
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