SCHEMBL10840787

SCHEMBL10840787

CC1CCc2cccc(C(F)(F)F)c2N1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 1/20 0.43
▸ PNMT P11086 1/20 0.40
▸ MEN1 O00255 1/20 0.36
▸ HSPA1A P0DMV8 1/20 0.36
▸ HSPA8 P11142 1/20 0.36
▸ PTPN7 P35236 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ HTR2C P28335 7/20 0.35
▸ CES1 P23141 1/20 0.35
▸ HTR2B P41595 4/20 0.34
▸ CHRNB2 P17787 1/20 0.33
▸ CHRNA4 P43681 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HTR2A P28223 3/20 0.33
▸ PARP1 P09874 1/20 0.33
▸ TRPV1 Q8NER1 1/20 0.32
▸ GRM2 Q14416 1/20 0.32
▸ PDE7A Q13946 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
SCHEMBL10841161 0.78 ALDH1A1 (0.39) MEN1KMT2AALDH1A1
SCHEMBL10840679 0.76 MEN1 (0.50) MEN1KMT2AHTR2CHTR2BALDH1A1
SCHEMBL30163317 0.76 MEN1 (0.50) MEN1KMT2AHTR2CHTR2BALDH1A1
SCHEMBL9394752 0.75 CD44 (0.36) MEN1KMT2AALDH1A1
SCHEMBL3950953 0.75 CHRM3 (0.41) HTR2CHTR2BHTR2A
SCHEMBL10841078 0.75 HTR2C (0.41) PNMTMEN1KMT2AHTR2CHTR2B
SCHEMBL19511078 0.74 ALDH1A1 (0.35) ARMEN1KMT2AALDH1A1
SCHEMBL10840744 0.72 PDK2 (0.39) MEN1KMT2AHTR2CHTR2BALDH1A1
SCHEMBL18602431 0.72 HTR1A (0.40) ARMEN1KMT2AALDH1A1
SCHEMBL11422593 0.72 DRD2 (0.46) —

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
EP-0198264-A2 Carbamoyl imidazoles NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1986-10-22 — — EP disclosed
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