SCHEMBL16430035

SCHEMBL16430035

COc1ccc(CCN2C[C@H](C(O)[C@H](F)S(=O)(=O)c3ccccc3)CC2=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.44
▸ POLB P06746 3/20 0.44
▸ TSHR P16473 1/20 0.44
▸ KMT2A Q03164 4/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ GAA P10253 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ RAB9A P51151 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ KCNA5 P22460 1/20 0.39
▸ KCNH2 Q12809 1/20 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
SCHEMBL16429897 0.84 KMT2A (0.48) POLBKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL16428153 0.79 KMT2A (0.42) ALDH1A1KMT2AMAPTSMN1; SMN2RAB9A
SCHEMBL14662358 0.78 KMT2A (0.48) POLBTSHRKMT2AMEN1SMN1; SMN2
SCHEMBL16430127 0.78 KMT2A (0.48) POLBKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL16429891 0.77 KMT2A (0.47) KMT2AMEN1SMN1; SMN2RAB9ANPC1
SCHEMBL16430114 0.75 KMT2A (0.47) KMT2AMEN1SMN1; SMN2RAB9ANPC1
SCHEMBL16430468 0.75 KMT2A (0.47) KMT2AMEN1SMN1; SMN2RAB9ANPC1
SCHEMBL16430124 0.74 KMT2A (0.48) POLBKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL16430034 0.74 KMT2A (0.45) KMT2AMEN1SMN1; SMN2RAB9ANPC1
SCHEMBL16430048 0.74 KCNA5 (0.46) POLBKMT2AMEN1KCNA5KCNH2

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-3027601-A1 SYK INHIBITORS Gilead Sciences, Inc. (US) 2016-06-08 — — EP disclosed
WO-2015017610-A1 SYK INHIBITORS GILEAD SCIENCES, INC. (US) 2015-02-05 — — WO disclosed
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