SCHEMBL5242687

SCHEMBL5242687

COCCOc1ccc(CCN2CCN(c3cc(F)c(F)c(OC)c3)CC2)c(C)c1C

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.43
▸ MAPT P10636 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ ABCB1 P08183 4/20 0.39
▸ HTR1A P08908 2/20 0.37
▸ SIGMAR1 Q99720 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
SCHEMBL5243868 0.85 LMNA (0.45) LMNAMAPTMEN1KMT2AHTR1A
SCHEMBL5241842 0.83 LMNA (0.43) LMNAMAPTMEN1KMT2AABCB1
SCHEMBL5244012 0.81 LMNA (0.41) LMNAMAPTMEN1KMT2AHTR1A
SCHEMBL5242682 0.78 ADAMTS5 (0.39) MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL5183035 0.76 LMNA (0.49) LMNAMAPTSMN1; SMN2MEN1KMT2A
SCHEMBL6628361 0.76 LMNA (0.56) LMNAMAPTSMN1; SMN2MEN1KMT2A
SCHEMBL5242970 0.74 LMNA (0.43) LMNAMAPTABCB1HTR1A
SCHEMBL5242930 0.74 HTR1A (0.43) HTR1A
SCHEMBL6625036 0.73 LMNA (0.55) LMNAMAPTSMN1; SMN2MEN1KMT2A
SCHEMBL5183561 0.73 LMNA (0.52) LMNAMAPTSMN1; SMN2MEN1KMT2A

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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