SCHEMBL22695462

SCHEMBL22695462

Cc1ccc2c(c1C)NC(=O)C1(CC1)O2

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ MAP4K1 Q92918 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ NR3C2 P08235 1/20 0.31

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
SCHEMBL22803134 0.81 — —
SCHEMBL22695465 0.71 MAP4K1 (0.44) MAP4K1
SCHEMBL31515402 0.70 PDE7A (0.38) ALDH1A1
SCHEMBL17348473 0.69 NR3C2 (0.57) ALDH1A1KMT2ASMN1; SMN2HSD17B10TP53
SCHEMBL24427221 0.67 HTT (0.45) ALDH1A1KMT2ASMN1; SMN2KDM4E
SCHEMBL17348471 0.66 KDM4E (0.36) ALDH1A1KMT2ASMN1; SMN2HSD17B10KDM4E
SCHEMBL25247621 0.65 PIM1 (0.32) —
SCHEMBL24307261 0.65 MMP12 (0.50) ALDH1A1SMN1; SMN2HSD17B10KDM4EHPGD
SCHEMBL24306751 0.65 MMP12 (0.50) ALDH1A1SMN1; SMN2HSD17B10KDM4EHPGD
SCHEMBL24307026 0.65 POLB (0.33) HPGDTP53NR3C2

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
WO-2020237025-A1 SUBSTITUTED EXO-METHYLENE-OXINDOLES WHICH ARE HPK1/MAP4K1 INHIBITORS GILEAD SCIENCES, INC. (US) 2020-11-26 — — WO disclosed
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