SCHEMBL5244297

SCHEMBL5244297

COc1cc(N2CCN(CCc3ccc(OCCCNCC4CC4)c(C)c3C)CC2)ccc1Cl

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 12/20 0.41
▸ HTR2A P28223 1/20 0.37
▸ HTR2C P28335 1/20 0.37
▸ HTR2B P41595 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ CCR1 P32246 2/20 0.37
▸ HTR1A P08908 1/20 0.37
▸ HTR7 P34969 1/20 0.37

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
SCHEMBL5242277 0.90 BRD4 (0.40) HTR2AHTR2CHTR2BLMNAMAPT
SCHEMBL5244935 0.88 LMNA (0.41) HTR2AHTR2CHTR2BLMNAMAPT
SCHEMBL5242275 0.87 LMNA (0.40) HTR2AHTR2CHTR2BLMNAMAPT
SCHEMBL5243013 0.86 HTR1A (0.43) LMNAMAPTCCR1HTR1AHTR7
SCHEMBL5243314 0.85 LMNA (0.39) F10HTR2AHTR2CHTR2BLMNA
SCHEMBL5242970 0.85 LMNA (0.43) HTR2AHTR2CHTR2BLMNAMAPT
SCHEMBL5241842 0.84 LMNA (0.43) HTR2AHTR2CHTR2BLMNAMAPT
SCHEMBL5183561 0.83 LMNA (0.52) LMNAMAPTCCR1HTR7
SCHEMBL5245094 0.83 SUV39H2 (0.44) HTR2AHTR2CLMNAMAPT
SCHEMBL5240767 0.82 SUV39H2 (0.42) HTR2AHTR2CHTR2BLMNAMAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1756107-A2 ARYL-SUBSTITUTED PIPERAZINE DERIVATIVES NEUROGEN CORPORATION (US) 2007-02-28 — — EP claimed
WO-2006009789-A2 ARYL-SUBSTITUTED PIPERAZINE DERIVATIVES NEUROGEN CORPORATION (US) 2006-01-26 — — WO claimed
Send feedback