SCHEMBL5242277

SCHEMBL5242277

CCNCCCOc1ccc(CCN2CCN(c3ccc(Cl)c(OC)c3)CC2)c(C)c1C

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 2/20 0.40
▸ LMNA P02545 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HTR7 P34969 2/20 0.38
▸ ABCB1 P08183 3/20 0.38
▸ HTR2A P28223 2/20 0.37
▸ HTR2C P28335 1/20 0.37
▸ HTR2B P41595 1/20 0.37
▸ CCR1 P32246 4/20 0.37
▸ DRD2 P14416 2/20 0.37
▸ DRD4 P21917 1/20 0.37
▸ DRD3 P35462 1/20 0.37
▸ HTR1A P08908 1/20 0.37
▸ ADRA1A P35348 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
SCHEMBL5244935 0.91 LMNA (0.41) LMNAMAPTHTR7ABCB1HTR2A
SCHEMBL5242275 0.90 LMNA (0.40) LMNAMAPTHTR7ABCB1HTR2A
SCHEMBL5242970 0.90 LMNA (0.43) BRD4LMNAMAPTHTR7ABCB1
SCHEMBL5244297 0.90 F10 (0.41) LMNAMAPTHTR7HTR2AHTR2C
SCHEMBL5243314 0.89 LMNA (0.39) LMNAMAPTHTR7ABCB1HTR2A
SCHEMBL5241842 0.87 LMNA (0.43) LMNAMAPTABCB1HTR2AHTR2C
SCHEMBL5183561 0.86 LMNA (0.52) LMNAMAPTHTR7CCR1
SCHEMBL5245094 0.85 SUV39H2 (0.44) LMNAMAPTHTR2AHTR2C
SCHEMBL5240767 0.85 SUV39H2 (0.42) LMNAMAPTABCB1HTR2AHTR2C
SCHEMBL5242204 0.81 LMNA (0.42) LMNAMAPTCCR1

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
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