SCHEMBL9624108

SCHEMBL9624108

CCCCCCCCc1cnc(-c2ccc(OCC(C)OC(=O)CCCC)c(F)c2)nc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 4/20 0.47
▸ RARA P10276 1/20 0.40
▸ RARG P13631 1/20 0.40
▸ THRA P10827 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ USP2 O75604 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ NPC1 O15118 1/20 0.37
▸ NFKB1 P19838 1/20 0.37
▸ NFKB2 Q00653 1/20 0.37
▸ RELA Q04206 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
SCHEMBL9624704 0.89 RAB9A (0.47) RARBRARARARGTHRBRAB9A
SCHEMBL9625651 0.87 RARB (0.51) RARBRARARARGTHRATHRB
SCHEMBL9398914 0.87 RARB (0.54) RARBRARARARGTHRATHRB
SCHEMBL9625680 0.86 RARB (0.53) RARBRARARARGMAPTMEN1
SCHEMBL9399379 0.86 RARB (0.52) RARBRARARARGTHRATHRB
SCHEMBL9625917 0.85 RARB (0.51) RARBRARARARGMAPTMEN1
SCHEMBL9794786 0.85 RARB (0.46) RARBRARARARGRAB9ASMN1; SMN2
SCHEMBL9625486 0.84 RARB (0.56) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL9794784 0.83 RARB (0.46) RARBRARARARGTHRATHRB
SCHEMBL9794790 0.83 RARB (0.46) RARBRARARARGTHRATHRB

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-0255219-B1 OMEGA-SUBSTITUTED, OPTICALLY ACTIVE 2-ALKANOL ESTER DERIVATIVES Chisso Corporation (JP) 1992-03-11 — — EP disclosed
US-5047172-A W-substituted, optically active alkanol ester derivatives CHISSO CORPORATION (JP) 1991-09-10 — — US disclosed
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