SCHEMBL9501403

SCHEMBL9501403

[CH2]c1cccc(-c2ccc(CCCCC)cc2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 2/20 0.49
▸ RARB P10826 9/20 0.49
▸ HSD17B10 Q99714 2/20 0.49
▸ TSHR P16473 1/20 0.49
▸ RARA P10276 2/20 0.48
▸ RARG P13631 1/20 0.48
▸ ALDH1A1 P00352 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ MTOR P42345 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ HRH3 Q9Y5N1 1/20 0.45
▸ ESR1 P03372 2/20 0.44
▸ ADRA2A P08913 2/20 0.44
▸ ADORA3 P0DMS8 2/20 0.44
▸ TACR2 P21452 2/20 0.44
▸ SLC6A2 P23975 2/20 0.44
▸ SLC6A4 P31645 2/20 0.44
▸ SLC6A3 Q01959 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44

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
SCHEMBL2094335 0.95 HSD11B1 (0.47) HSD11B1RARBHSD17B10TSHRRARA
SCHEMBL6745029 0.82 RARB (0.58) HSD11B1RARBHSD17B10TSHRRARA
SCHEMBL28364847 0.81 BCL2 (0.53) HSD11B1RARBHSD17B10TSHRRARA
SCHEMBL9658418 0.81 HSD11B1 (0.54) HSD11B1RARBHSD17B10TSHRRARA
SCHEMBL27958067 0.80 HSD17B10 (0.61) RARBHSD17B10TSHRRARARARG
SCHEMBL6747872 0.80 HSD17B10 (0.61) RARBHSD17B10TSHRRARARARG
SCHEMBL5252629 0.80 LPL (0.56) CYP3A4PTGS2LPLLIPG
SCHEMBL1817958 0.80 TAAR1 (0.63) HSD11B1RARBHSD17B10TSHRRARA
Bromide SCHEMBL28347006 0.80 HSD11B1 (0.53) HSD11B1RARBHSD17B10TSHRRARA
SCHEMBL1203500 0.80 HSD11B1 (0.69) HSD11B1RARBHSD17B10TSHRRARA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0273444-B1 USE OF CARBOXAMIDE COMPOUNDS FOR THE PREPARATION OF A MEDICAMENT FOR TREATING HYPERLIPIDEMIA OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1993-05-05 — — EP disclosed
US-5081112-A Administering an aryl phosphonate carboxamide OTSUKA PHARMACEUTICAL FACTORY INC. (JP) 1992-01-14 — — US disclosed
EP-0273444-A2 Use of carboxamide compounds for the preparation of a medicament for treating hyperlipidemia OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1988-07-06 — — EP disclosed
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