SCHEMBL9532783

SCHEMBL9532783

CCCC1[CH]c2ccccc2C1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 1/20 0.39
KDM4E B2RXH2 3/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PSEN1 P49768 4/20 0.34
PSEN2 P49810 4/20 0.34
APH1B Q8WW43 4/20 0.34
NCSTN Q92542 4/20 0.34
APH1A Q96BI3 4/20 0.34
PSENEN Q9NZ42 4/20 0.34
HTR1A P08908 1/20 0.34
ALDH1A1 P00352 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
IDO1 P14902 2/20 0.32
FYN P06241 1/20 0.32
SIGMAR1 Q99720 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
SCHEMBL9531143 0.84 KDM4E (0.39) DRD3KDM4EL3MBTL1PSEN1PSEN2
SCHEMBL9532881 0.81 HTR1A (0.39) HTR1ASIGMAR1
SCHEMBL28306580 0.81 DRD3 (0.37) DRD3KDM4EL3MBTL1HTR1AIDO1
SCHEMBL9531644 0.69 HTR1A (0.38) HTR1ASIGMAR1
SCHEMBL9531823 0.69 POLB (0.38) KDM4EALDH1A1
SCHEMBL17765425 0.69 IDO1 (0.38) KDM4EL3MBTL1IDO1
SCHEMBL3916886 0.69 FYN (0.57) DRD3PSEN1PSEN2APH1BNCSTN
SCHEMBL22554804 0.69 CYP19A1 (0.39) KDM4EL3MBTL1IDO1
SCHEMBL1702930 0.69 CYP19A1 (0.39) KDM4EL3MBTL1IDO1
SCHEMBL7467962 0.68 DRD3 (0.38) DRD3KDM4EL3MBTL1HTR1AALDH1A1

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