SCHEMBL28161450

SCHEMBL28161450

FC(F)(Br)Oc1cccc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.51
▸ HSD17B10 Q99714 4/20 0.51
▸ KDM4E B2RXH2 3/20 0.51
▸ HPGD P15428 2/20 0.44
▸ HTR1B P28222 7/20 0.44
▸ HTT P42858 1/20 0.44
▸ TDP1 Q9NUW8 2/20 0.42
▸ KCNA3 P22001 1/20 0.42
▸ KMT2A Q03164 3/20 0.41
▸ PGR P06401 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ PTGS1 P23219 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ HTR1D P28221 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ HRH1 P35367 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40

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
SCHEMBL3120591 0.85 KDM4E (0.53) ALDH1A1HSD17B10KDM4EHPGDHTR1B
SCHEMBL16178487 0.84 ALDH1A1 (0.49) ALDH1A1HSD17B10KDM4EHPGDHTR1B
SCHEMBL17537056 0.84 ALDH1A1 (0.49) ALDH1A1HSD17B10KDM4EHPGDHTR1B
SCHEMBL8026143 0.83 ALDH1A1 (0.55) ALDH1A1HSD17B10KDM4EHPGDHTR1B
SCHEMBL17271346 0.82 ALDH1A1 (0.50) ALDH1A1HSD17B10KDM4EHPGDHTR1B
SCHEMBL10713653 0.79 ALDH1A1 (0.47) ALDH1A1HSD17B10KDM4EHPGDHTR1B
SCHEMBL15157392 0.79 ALDH1A1 (0.56) ALDH1A1HSD17B10KDM4EHPGDHTR1B
SCHEMBL20002024 0.79 ALDH1A1 (0.56) ALDH1A1HSD17B10KDM4EHPGDHTR1B
SCHEMBL11064711 0.78 ALDH1A1 (0.54) ALDH1A1HSD17B10KDM4EHPGDHTR1B
SCHEMBL31091502 0.77 ALDH1A1 (0.62) ALDH1A1HSD17B10KDM4EHPGDHTR1B

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
CN-104603118-B Carboxamide or sulfonamide substituted thiazoles and related derivatives as modulators of the orphan nuclear receptor ROR γ 菲尼克斯药品股份公司 2017-10-03 — — CN disclosed
CN-107007597-A It is used as the thiazole of orphan nuclear receptor ROR γ instrumentalities through formamide or sulfonamide substitutions and the pharmaceutical applications of related derivatives 菲尼克斯药品股份公司 2017-08-04 — — CN disclosed
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