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SCHEMBL325537

SCHEMBL325537

Cn1cnc(S(=O)(=O)N(Cc2ccc(Cl)cc2)c2ccc(C(=O)N3CCCC(Oc4ccccc4)C3)cc2)c1.O=C(c1ccc(NCc2ccc(Cl)cc2)cc1)N1CCCC(c2ccccc2)C1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PROKR1 Q8TCW9 12/20 0.39
▸ LMNA P02545 4/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ HPGD P15428 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ POLB P06746 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
SCHEMBL1722907 0.91 LMNA (0.44) LMNAALDH1A1HPGDSMN1; SMN2POLB
SCHEMBL1722509 0.89 PROKR1 (0.47) PROKR1LMNAALDH1A1HPGDHIF1A
SCHEMBL3262363 0.84 PROKR1 (0.46) PROKR1LMNAALDH1A1HPGDHIF1A
SCHEMBL304021 0.84 PROKR1 (0.49) PROKR1LMNAALDH1A1HPGDHIF1A
SCHEMBL3235160 0.79 GRM5 (0.49) ALDH1A1POLB
SCHEMBL1723221 0.79 GRM5 (0.49) LMNAALDH1A1HPGDSMN1; SMN2POLB
SCHEMBL327168 0.76 LMNA (0.48) LMNAALDH1A1HPGDSMN1; SMN2
SCHEMBL3264724 0.76 ALDH1A1 (0.55) PROKR1LMNAALDH1A1HPGDHIF1A
SCHEMBL1710991 0.76 LMNA (0.47) LMNAALDH1A1HPGDSMN1; SMN2
SCHEMBL303461 0.76 LMNA (0.43) LMNAALDH1A1HPGDSMN1; SMN2POLB

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
JP-2012500834-A — — 2012-01-12 — — JP claimed
EP-2344456-A1 NOVEL POTASSIUM CHANNEL BLOCKER Xention Limited (GB) 2011-07-20 — — EP claimed