SCHEMBL10656326

SCHEMBL10656326

CCCCCCCCc1cnc(-c2ccc(-c3ccc(OC(=O)C(Cl)C(C)CCCC(C)C)cc3)cc2)nc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 6/20 0.51
SMN1; SMN2 Q16637 4/20 0.43
MAPT P10636 4/20 0.43
RAB9A P51151 4/20 0.41
MEN1 O00255 2/20 0.41
ALDH1A1 P00352 2/20 0.41
KMT2A Q03164 2/20 0.41
HSD17B10 Q99714 2/20 0.41
KDM4E B2RXH2 1/20 0.41
USP2 O75604 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
NPSR1 Q6W5P4 1/20 0.38
NPC1 O15118 2/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
RARA P10276 1/20 0.37
MTOR P42345 1/20 0.37
THRA P10827 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
SCHEMBL10660350 1.00 RARB (0.51) RARBSMN1; SMN2MAPTRAB9AMEN1
SCHEMBL10657182 1.00 RARB (0.51) RARBSMN1; SMN2MAPTRAB9AMEN1
SCHEMBL10656576 1.00 RARB (0.51) RARBSMN1; SMN2MAPTRAB9AMEN1
SCHEMBL10658338 1.00 RARB (0.51) RARBSMN1; SMN2MAPTRAB9AMEN1
SCHEMBL10656367 0.99 RARB (0.52) RARBSMN1; SMN2MAPTRAB9AMEN1
SCHEMBL10656505 0.99 RARB (0.52) RARBSMN1; SMN2MAPTRAB9AMEN1
SCHEMBL10658636 0.99 RARB (0.52) RARBSMN1; SMN2MAPTRAB9AMEN1
SCHEMBL10654132 0.99 RARB (0.52) RARBSMN1; SMN2MAPTRAB9AMEN1
SCHEMBL10653422 0.99 RARB (0.52) RARBSMN1; SMN2MAPTRAB9AMEN1
SCHEMBL10658006 0.99 RARB (0.52) RARBSMN1; SMN2MAPTRAB9AMEN1

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-0257048-A1 OPTICALLY ACTIVE COMPOUNDS. MERCK PATENT GMBH (DE) 1988-03-02 EP disclosed
WO-1987005018-A2 OPTICALLY ACTIVE COMPOUNDS MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1987-08-27 WO disclosed