SCHEMBL8350646

SCHEMBL8350646

CCOC(=O)Cc1nc(C(=O)CN2CCN(c3ccccc3C(c3ccccc3)c3ccc(Cl)cc3)CC2)sc1N

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 7/20 0.37
▸ HTR2A P28223 4/20 0.37
▸ HTR2C P28335 3/20 0.37
▸ MAPT P10636 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ RECQL P46063 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ MC4R P32245 1/20 0.35
▸ CACNA2D1 P54289 1/20 0.34
▸ CACNA1B Q00975 1/20 0.34
▸ CACNB1 Q02641 1/20 0.34
▸ CACNA1C Q13936 1/20 0.34
▸ PRMT1 Q99873 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ LMNA P02545 1/20 0.33

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
SCHEMBL8511036 0.78 CACNA2D1 (0.31) CACNA2D1CACNA1BCACNB1CACNA1CLMNA
SCHEMBL8350643 0.77 MAPT (0.50) MAPTMEN1TSHRKMT2AALDH1A1
SCHEMBL8350645 0.66 MAPT (0.52) MAPTTSHRALDH1A1KDM4ELMNA
SCHEMBL8350338 0.65 MAPT (0.55) MAPTTSHRKMT2AALDH1A1KDM4E
SCHEMBL14860144 0.65 CACNA2D1 (0.66) SLC6A4HTR2ACACNA2D1CACNA1BCACNB1
SCHEMBL8356732 0.64 SMN1; SMN2 (0.43) MAPTMEN1KMT2AALDH1A1
SCHEMBL28360934 0.64 ALDH1A1 (0.55) SLC6A4HTR2AHTR2CMAPTMEN1
SCHEMBL3436279 0.62 MAPT (0.57) SLC6A4MAPTALDH1A1KDM4ELMNA
SCHEMBL11173493 0.61 ATM (0.45) MEN1KMT2ACACNA2D1CACNA1BCACNB1
SCHEMBL4714358 0.61 KCNQ2 (0.43) SLC6A4MAPTMEN1TSHRKMT2A

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
WO-1999031096-A1 PIPERAZINE DERIVATIVES USEFUL AS HYPOGLYCEMIC AGENTS SHAMAN PHARMACEUTICALS, INC. (US) 1999-06-24 — — WO claimed
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