SCHEMBL1727773

SCHEMBL1727773

O=C(O)NCC1CCN(c2ncccc2-c2ccccc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 1/20 0.54
▸ CKS1B P61024 11/20 0.49
▸ SKP1 P63208 11/20 0.49
▸ SKP2 Q13309 11/20 0.49
▸ LRRK2 Q5S007 1/20 0.45
▸ LDHA P00338 1/20 0.44
▸ MALT1 Q9UDY8 1/20 0.44
▸ HTR1A P08908 1/20 0.44
▸ DRD2 P14416 1/20 0.44
▸ HTR7 P34969 1/20 0.44
▸ HTR6 P50406 1/20 0.44
▸ KMT2A Q03164 1/20 0.43
▸ USP30 Q70CQ3 1/20 0.43

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
SCHEMBL1727778 0.91 P2RX7 (0.53) P2RX7CKS1BSKP1SKP2LDHA
SCHEMBL1730153 0.88 CHRM4 (0.52) P2RX7LRRK2MALT1HTR1ADRD2
SCHEMBL3265694 0.84 P2RX7 (0.47) P2RX7CKS1BSKP1SKP2LRRK2
SCHEMBL1728655 0.83 MALT1 (0.45) P2RX7CKS1BSKP1SKP2LDHA
SCHEMBL1727869 0.82 KDM4E (0.62) P2RX7LDHAMALT1DRD2
SCHEMBL1727561 0.81 KMT2A (0.48) P2RX7CKS1BSKP1SKP2MALT1
SCHEMBL1728967 0.80 NSD2 (0.47) P2RX7CKS1BSKP1SKP2HTR1A
SCHEMBL1728699 0.80 HRH4 (0.51) CKS1BSKP1SKP2MALT1
SCHEMBL22776419 0.79 ALDH1A1 (0.52) CKS1BSKP1SKP2HTR1ADRD2
SCHEMBL3265672 0.76 CHRM4 (0.45) P2RX7LRRK2HTR1ADRD2HTR7

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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