SCHEMBL28672390

SCHEMBL28672390

O=C(Oc1ccc(F)cc1F)C1CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 4/20 0.51
▸ TSHR P16473 2/20 0.51
▸ POLB P06746 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ KMT2A Q03164 2/20 0.49
▸ RAB9A P51151 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ TDP1 Q9NUW8 3/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ HTT P42858 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ GAA P10253 1/20 0.41
▸ ESR1 P03372 1/20 0.41
▸ ESR2 Q92731 1/20 0.41
▸ CES2 O00748 1/20 0.40
▸ CES1 P23141 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ HPGD P15428 2/20 0.39

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
SCHEMBL28688377 0.89 MAPK1 (0.46) L3MBTL1TSHRPOLBMAPK1KMT2A
SCHEMBL11033321 0.85 POLB (0.44) L3MBTL1TSHRPOLBMAPK1KMT2A
SCHEMBL10926531 0.85 POLB (0.44) L3MBTL1TSHRPOLBMAPK1KMT2A
SCHEMBL27641736 0.83 KMT2A (0.43) L3MBTL1POLBMAPK1KMT2ARAB9A
SCHEMBL27676369 0.83 KMT2A (0.51) L3MBTL1KMT2ARAB9AMEN1TDP1
SCHEMBL10926562 0.83 FAAH (0.44) L3MBTL1TSHRPOLBMAPK1KMT2A
SCHEMBL11035609 0.83 POLB (0.42) L3MBTL1TSHRPOLBMAPK1KMT2A
SCHEMBL28393952 0.82 L3MBTL1 (0.65) L3MBTL1POLBKMT2ARAB9AMEN1
SCHEMBL10926617 0.82 FAAH (0.43) L3MBTL1TSHRPOLBMAPK1KMT2A
SCHEMBL10926539 0.82 FAAH (0.43) L3MBTL1TSHRPOLBMAPK1KMT2A

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-113861072-A Preparation method of aryl cyclopropane compound 上海麦克林生化科技有限公司 2021-12-31 — — CN disclosed
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