SCHEMBL19429526

SCHEMBL19429526

CC1CCC(c2cc(Br)c3c(N)ncnn23)CC1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ACVRL1 P37023 11/20 0.45
▸ CSNK2A2 P19784 1/20 0.42
▸ CSNK2A1 P68400 1/20 0.42
▸ MTOR P42345 1/20 0.41
▸ RICTOR Q6R327 1/20 0.41
▸ RPTOR Q8N122 1/20 0.41
▸ MAPKAP1 Q9BPZ7 1/20 0.41
▸ MLST8 Q9BVC4 1/20 0.41
▸ PIK3CD O00329 7/20 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
SCHEMBL31391141 0.93 ACVRL1 (0.49) ACVRL1MTORRICTORRPTORMAPKAP1
SCHEMBL16011302 0.86 ACVRL1 (0.58) ACVRL1CSNK2A2CSNK2A1MTORRICTOR
SCHEMBL16011301 0.86 ACVRL1 (0.58) ACVRL1CSNK2A2CSNK2A1MTORRICTOR
SCHEMBL19377710 0.85 ACVRL1 (0.44) ACVRL1MTORRICTORRPTORMAPKAP1
SCHEMBL19377805 0.83 PIK3CD (0.53) ACVRL1CSNK2A2CSNK2A1PIK3CD
SCHEMBL19377690 0.83 ACVRL1 (0.61) ACVRL1MTORRICTORRPTORMAPKAP1
SCHEMBL19377514 0.83 TYRO3 (0.44) ACVRL1MTORRICTORRPTORMAPKAP1
SCHEMBL23834529 0.82 ACVRL1 (0.43) ACVRL1MTORRICTORRPTORMAPKAP1
Hydrochloric Acid SCHEMBL19377754 0.82 ACVRL1 (0.60) ACVRL1MTORRICTORRPTORMAPKAP1
Hydrochloric Acid SCHEMBL29720772 0.82 ACVRL1 (0.60) ACVRL1MTORRICTORRPTORMAPKAP1

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-2017172596-A1 PYRROLOTRIAZINE COMPOUNDS AS TAM INHIBITORS INCYTE CORPORATION (US) 2017-10-05 — — WO disclosed
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