SCHEMBL1728967

SCHEMBL1728967

O=C(O)NCCC1CCN(c2ncccc2-c2ccc(F)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NSD2 O96028 4/20 0.47
▸ CHRM4 P08173 6/20 0.47
▸ HTR1A P08908 2/20 0.46
▸ DRD2 P14416 2/20 0.46
▸ HTR7 P34969 2/20 0.46
▸ HTR6 P50406 2/20 0.46
▸ P2RX7 Q99572 1/20 0.45
▸ CHRM2 P08172 1/20 0.42
▸ CHRM1 P11229 1/20 0.42
▸ CKS1B P61024 1/20 0.42
▸ SKP1 P63208 1/20 0.42
▸ SKP2 Q13309 1/20 0.42
▸ RBP4 P02753 1/20 0.42
▸ TTR P02766 1/20 0.42

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
SCHEMBL1730153 0.91 CHRM4 (0.52) NSD2CHRM4HTR1ADRD2HTR7
SCHEMBL1727778 0.89 P2RX7 (0.53) HTR1ADRD2HTR7HTR6P2RX7
SCHEMBL3269154 0.85 HTR1A (0.43) NSD2CHRM4HTR1ADRD2HTR7
SCHEMBL1729840 0.81 KMT2A (0.45) HTR1ADRD2HTR7HTR6P2RX7
SCHEMBL1727773 0.80 P2RX7 (0.54) HTR1ADRD2HTR7HTR6P2RX7
SCHEMBL1730203 0.80 CHRM4 (0.51) NSD2CHRM4
SCHEMBL1727887 0.80 KDM4E (0.60) CHRM4DRD2
SCHEMBL344551 0.79 CHRM4 (0.60) CHRM4DRD2CHRM2
SCHEMBL1728840 0.79 HTR1A (0.39) HTR1ADRD2HTR7HTR6P2RX7
SCHEMBL2323704 0.78 CHRM4 (0.50) CHRM4CHRM2CHRM1CKS1BSKP1

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-1633735-B1 DERIVATIVES OF PIPERIDINYL- AND PIPERAZINYL-ALKYL CARBAMATES, PREPARATION METHODS THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI SA (FR) 2011-11-30 — — EP claimed
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