SCHEMBL9531785

SCHEMBL9531785

CCCC1(CCC)[CH]c2ccccc2CC1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.35
KDM1A O60341 4/20 0.35
MAOB P27338 4/20 0.34
MAOA P21397 2/20 0.34
EBP Q15125 1/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31

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
SCHEMBL9532323 0.85 MAOB (0.36) SIGMAR1KDM1AMAOB
SCHEMBL9532066 0.83 ALOX12 (0.34) KDM1AMAOBMAOA
SCHEMBL9531466 0.81 SIGMAR1 (0.34) SIGMAR1KDM1AMAOBMAOAEBP
SCHEMBL9533119 0.73 MAOB (0.35) SIGMAR1KDM1AMAOB
SCHEMBL9532397 0.71 NPSR1 (0.37) MAOB
SCHEMBL7883341 0.71 MAOB (0.39) SIGMAR1KDM1AMAOB
SCHEMBL9531388 0.69 ALOX12 (0.36) KDM1AMAOBMAOA
SCHEMBL19289267 0.67 ADRA2A (0.41) SIGMAR1KDM1AMAOBMAOA
SCHEMBL7782464 0.67 ESR2 (0.48) SIGMAR1KDM1AMAOBEBPESR1
SCHEMBL9532845 0.67 CHRM2 (0.31) KDM1AMAOBMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0314852-B1 Process for the preparation of 1-substituted imidazole-carbonic acid and derivatives CIBA GEIGY AG (CH) 1993-11-18 EP disclosed
US-4921955-A Process for the synthesis of 1-substituted imidazole-5-carboxylic acids and carboxylic acid derivatives CIBA-GEIGY CORPORATION (US) 1990-05-01 US disclosed
EP-0314852-A2 Process for the preparation of 1-substituted imidazole-carbonic acid and derivatives CIBA-GEIGY AG (CH) 1989-05-10 EP disclosed