SCHEMBL28524593

SCHEMBL28524593

C/C=C(\C)c1ccc(CCCC)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 7/20 0.56
▸ THRB P10828 7/20 0.56
▸ RARB P10826 2/20 0.53
▸ PLK1 P53350 1/20 0.53
▸ CA1 P00915 1/20 0.50
▸ CA2 P00918 1/20 0.50
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.48
▸ HSD17B10 Q99714 2/20 0.48
▸ HPGD P15428 1/20 0.48
▸ PLA2G1B P04054 1/20 0.47
▸ ATG4B Q9Y4P1 1/20 0.47
▸ ESR1 P03372 2/20 0.47
▸ ADRA2A P08913 2/20 0.47
▸ ADORA3 P0DMS8 2/20 0.47
▸ TACR2 P21452 2/20 0.47
▸ SLC6A2 P23975 2/20 0.47
▸ SLC6A4 P31645 2/20 0.47
▸ SLC6A3 Q01959 2/20 0.47

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
SCHEMBL27892537 1.00 THRA (0.56) THRATHRBRARBPLK1CA1
SCHEMBL22375068 0.85 THRA (0.53) THRATHRBRARBPLK1CA1
SCHEMBL18905452 0.82 HSD17B10 (0.41) THRATHRBRARBPLK1MEN1
SCHEMBL27887440 0.82 THRA (0.54) THRATHRBRARBPLK1MEN1
SCHEMBL15177389 0.82 THRA (0.58) THRATHRBRARBPLK1MEN1
SCHEMBL10938918 0.81 RARB (0.58) THRATHRBRARBPLK1CA1
SCHEMBL11570191 0.80 RARB (0.58) THRATHRBRARBPLK1ALDH1A1
SCHEMBL8732968 0.80 ESR1 (0.50) THRATHRBRARBPLK1CA1
SCHEMBL8732972 0.80 ESR1 (0.50) THRATHRBRARBPLK1CA1
SCHEMBL8729056 0.80 ESR1 (0.50) THRATHRBRARBPLK1CA1

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
CN-112299946-A Method for synthesizing 1, 2-disubstituted olefin by reacting terminal group olefin with sulfoxide 沅江华龙催化科技有限公司 2021-02-02 — — CN disclosed
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