SCHEMBL9817695

SCHEMBL9817695

CCCCCCCCc1cnc(-c2ccc(C(=O)Oc3ccc(-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
SCHEMBL9817389 1.00 RARB (0.70) RARBMAPTSMN1; SMN2THRBNPC1
SCHEMBL9817442 1.00 RARB (0.70) RARBMAPTSMN1; SMN2THRBNPC1
SCHEMBL9817469 1.00 RARB (0.70) RARBMAPTSMN1; SMN2THRBNPC1
SCHEMBL9817470 1.00 RARB (0.70) RARBMAPTSMN1; SMN2THRBNPC1
SCHEMBL9817412 1.00 RARB (0.70) RARBMAPTSMN1; SMN2THRBNPC1
SCHEMBL9817575 1.00 RARB (0.70) RARBMAPTSMN1; SMN2THRBNPC1
SCHEMBL9817342 1.00 RARB (0.70) RARBMAPTSMN1; SMN2THRBNPC1
SCHEMBL9817321 1.00 RARB (0.70) RARBMAPTSMN1; SMN2THRBNPC1
SCHEMBL9817440 1.00 RARB (0.70) RARBMAPTSMN1; SMN2THRBNPC1
SCHEMBL9817425 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
Send feedback