SCHEMBL9531388

SCHEMBL9531388

CCCC1(C)[CH]c2ccccc2C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX12 P18054 1/20 0.36
KMT2A Q03164 1/20 0.33
KDM4E B2RXH2 2/20 0.32
GAA P10253 1/20 0.32
KDM1A O60341 2/20 0.32
MAOA P21397 2/20 0.32
MAOB P27338 2/20 0.32
HTR2A P28223 1/20 0.32
DRD3 P35462 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
HTR1A P08908 1/20 0.30
DRD2 P14416 1/20 0.30
HTR2C P28335 1/20 0.30
HTR7 P34969 1/20 0.30
HRH1 P35367 1/20 0.30
HTR2B P41595 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
PRNP P04156 1/20 0.30
PPARG P37231 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL9530955 0.85 KMT2A (0.38) ALOX12KMT2AKDM4EGAAHTR2A
SCHEMBL9531466 0.82 SIGMAR1 (0.34) ALOX12KMT2AKDM4EGAAKDM1A
SCHEMBL9532066 0.81 ALOX12 (0.34) ALOX12KMT2AKDM4EGAAKDM1A
SCHEMBL9532397 0.72 NPSR1 (0.37) KMT2AKDM4EGAAMAOBHTR2A
SCHEMBL2581169 0.71 MAOB (0.33) KMT2AMAOBHTR2A
SCHEMBL9533119 0.70 MAOB (0.35) KMT2AKDM4EGAAKDM1AMAOB
SCHEMBL9536178 0.70 HTR1A (0.31) HTR1AHTR7HTR2B
SCHEMBL29174116 0.70 MAOB (0.32) KMT2AKDM4EGAAMAOBHTR2A
SCHEMBL9531785 0.69 SIGMAR1 (0.35) KDM1AMAOAMAOB
SCHEMBL18475190 0.66 CYP2D6 (0.41) ALOX12KMT2AMAOAMAOBHTR1A

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