SCHEMBL9530955

SCHEMBL9530955

CCC1(C)[CH]c2ccccc2C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 2/20 0.36
GAA P10253 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
PRNP P04156 1/20 0.34
PPARG P37231 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
NR2E3 Q9Y5X4 1/20 0.34
NCOR2 Q9Y618 1/20 0.34
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
ADRA1B P35368 1/20 0.33
HTR2A P28223 1/20 0.33
ALDH1A1 P00352 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
HTR1A P08908 1/20 0.32
DRD2 P14416 1/20 0.32

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
SCHEMBL9531388 0.85 ALOX12 (0.36) KMT2AKDM4EGAANPSR1PRNP
SCHEMBL9533119 0.81 MAOB (0.35) KMT2AKDM4EGAANPSR1PRNP
SCHEMBL9532397 0.79 NPSR1 (0.37) KMT2AKDM4EGAANPSR1PRNP
SCHEMBL2581169 0.74 MAOB (0.33) KMT2AHTR2AALDH1A1TSHR
SCHEMBL29174116 0.72 MAOB (0.32) KMT2AKDM4EGAAHTR2AALDH1A1
SCHEMBL9532066 0.72 ALOX12 (0.34) KMT2AKDM4EGAANPSR1ADRA2A
SCHEMBL9531466 0.71 SIGMAR1 (0.34) KMT2AKDM4EGAAALOX12
SCHEMBL9549356 0.68 PTGS1 (0.32) HTR2A
SCHEMBL19055588 0.68 MAOB (0.38) KMT2AKDM4EHTR2A
SCHEMBL22202324 0.68 KMT2A (0.35) KMT2AKDM4EGAANPSR1ADRA2A

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