SCHEMBL10840724

SCHEMBL10840724

Cc1c(Cl)ccc2c1NC(C)CC2

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 3/20 0.39
▸ CREBBP Q92793 3/20 0.39
▸ HTR2C P28335 10/20 0.36
▸ HTR2A P28223 9/20 0.36
▸ HTR2B P41595 7/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ CES1 P23141 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ NR4A1 P22736 1/20 0.33

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
SCHEMBL10840190 0.82 MEN1 (0.50) CREBBPHTR2CHTR2AHTR2BKDM4E
SCHEMBL19511078 0.81 ALDH1A1 (0.35) CREBBPKDM4EMEN1ALOX15KMT2A
SCHEMBL10841259 0.79 MEN1 (0.33) KDM4EMEN1ALOX15KMT2AHSD17B10
SCHEMBL10838799 0.79 AR (0.34) BRD4CREBBPHTR2CHTR2AHTR2B
SCHEMBL10841078 0.77 HTR2C (0.41) BRD4CREBBPHTR2CHTR2BMEN1
Hydrochloric Acid SCHEMBL11332118 0.73 HTR2C (0.39) HTR2CHTR2AHTR2B
SCHEMBL10840679 0.71 MEN1 (0.50) CREBBPHTR2CHTR2AHTR2BKDM4E
SCHEMBL19511452 0.69 SRC (0.35) —
SCHEMBL19056900 0.69 CCR1 (0.42) HTR2CHTR2AHTR2BKCNH2
SCHEMBL9510659 0.68 PNMT (0.42) HTR2CHTR2AHTR2BKCNH2CES1

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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