SCHEMBL9817633

SCHEMBL9817633

CCCCCCCCCCc1cnc(-c2ccc(OC(=O)c3ccc(-c4ncc(CCCCCCC)cn4)cc3)cc2)nc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.70
MAPT P10636 8/20 0.68
SMN1; SMN2 Q16637 6/20 0.68
THRB P10828 2/20 0.56
NPC1 O15118 4/20 0.54
NFKB1 P19838 4/20 0.54
NFKB2 Q00653 4/20 0.54
RELA Q04206 4/20 0.54
LMNA P02545 3/20 0.54
KMT2A Q03164 4/20 0.52
MEN1 O00255 2/20 0.52
ALDH1A1 P00352 2/20 0.52
HPGD P15428 2/20 0.52
RAB9A P51151 2/20 0.52
KDM4E B2RXH2 1/20 0.52
USP2 O75604 1/20 0.52
GAA P10253 1/20 0.52
HSD17B10 Q99714 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52

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
SCHEMBL9817415 1.00 RARB (0.70) RARBMAPTSMN1; SMN2THRBNPC1
SCHEMBL9817542 1.00 RARB (0.70) RARBMAPTSMN1; SMN2THRBNPC1
SCHEMBL9817667 1.00 RARB (0.70) RARBMAPTSMN1; SMN2THRBNPC1
SCHEMBL9817550 1.00 RARB (0.70) RARBMAPTSMN1; SMN2THRBNPC1
SCHEMBL9817532 1.00 RARB (0.70) RARBMAPTSMN1; SMN2THRBNPC1
SCHEMBL9817449 1.00 RARB (0.70) RARBMAPTSMN1; SMN2THRBNPC1
SCHEMBL9817402 1.00 RARB (0.70) RARBMAPTSMN1; SMN2THRBNPC1
SCHEMBL9817373 1.00 RARB (0.70) RARBMAPTSMN1; SMN2THRBNPC1
SCHEMBL9817401 1.00 RARB (0.70) RARBMAPTSMN1; SMN2THRBNPC1
SCHEMBL9817524 1.00 RARB (0.70) RARBMAPTSMN1; SMN2THRBNPC1

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
US-5055221-A Rapidly switching ferroelectric display element MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1991-10-08 US disclosed