SCHEMBL5183561

SCHEMBL5183561

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

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.52
▸ MAPT P10636 1/20 0.52
▸ CCR1 P32246 8/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ SIGMAR1 Q99720 1/20 0.43
▸ HTR7 P34969 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ KCNH2 Q12809 1/20 0.42
▸ TP53BP1 Q12888 1/20 0.41
▸ L3MBTL3 Q96JM7 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL5183909 0.92 LMNA (0.51) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL5241842 0.91 LMNA (0.43) LMNAMAPTCCR1MEN1KMT2A
SCHEMBL6628361 0.90 LMNA (0.56) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL5183035 0.90 LMNA (0.49) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL5242970 0.90 LMNA (0.43) LMNAMAPTCCR1HTR7
SCHEMBL5242204 0.89 LMNA (0.42) LMNAMAPTCCR1MEN1KMT2A
SCHEMBL5243013 0.89 HTR1A (0.43) LMNAMAPTCCR1MEN1KMT2A
SCHEMBL5245094 0.87 SUV39H2 (0.44) LMNAMAPT
SCHEMBL5244935 0.87 LMNA (0.41) LMNAMAPTCCR1HTR7
SCHEMBL6622755 0.87 LMNA (0.47) LMNAMAPTCCR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1389189-A2 MELANIN CONCENTRATING HORMONE RECEPTOR LIGANDS: SUBSTITUTED 1-BENZYL-4-ARYL PIPERAZINE ANALOGUES NEUROGEN CORPORATION (US) 2004-02-18 — — EP claimed
WO-2002094799-A2 MELANIN CONCENTRATING HORMONE RECEPTOR LIGANDS: SUBSTITUTED 1-BENZYL-4-ARYL PIPERAZINE ANALOGUES NEUROGEN CORPORATION (US) 2002-11-28 — — WO claimed
EP-1729762-A4 COMBINATION THERAPY FOR WEIGHT MANAGEMENT NEUROGEN CORP (US) 2007-12-19 — — EP disclosed
EP-1729762-A2 COMBINATION THERAPY FOR WEIGHT MANAGEMENT NEUROGEN CORPORATION (US) 2006-12-13 — — EP disclosed
WO-2005094305-A2 COMBINATION THERAPY FOR WEIGHT MANAGEMENT NEUROGEN CORPORATION (US) 2005-10-13 — — WO disclosed
EP-1389189-A2 MELANIN CONCENTRATING HORMONE RECEPTOR LIGANDS: SUBSTITUTED 1-BENZYL-4-ARYL PIPERAZINE ANALOGUES NEUROGEN CORPORATION (US) 2004-02-18 — — EP disclosed
WO-2002094799-A2 MELANIN CONCENTRATING HORMONE RECEPTOR LIGANDS: SUBSTITUTED 1-BENZYL-4-ARYL PIPERAZINE ANALOGUES NEUROGEN CORPORATION (US) 2002-11-28 — — WO disclosed
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