SCHEMBL11332282

SCHEMBL11332282

CNC(=O)Sc1ccccc1Cl

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 1/20 0.60
▸ TERT O14746 1/20 0.42
▸ MAPT P10636 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ LDHA P00338 2/20 0.39
▸ POLB P06746 2/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ CES2 O00748 1/20 0.38
▸ CES1 P23141 1/20 0.38
▸ PKM P14618 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ TP53 P04637 1/20 0.36

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
SCHEMBL11342337 0.80 IDO1 (0.55) IDO1TERTMAPTKMT2AMEN1
SCHEMBL28469527 0.78 CA12 (0.57) IDO1TERTMAPTKMT2AMEN1
SCHEMBL8536411 0.76 IDO1 (0.54) IDO1TERTMAPTKMT2AMEN1
SCHEMBL10397164 0.76 CA12 (0.65) KMT2AALDH1A1SMN1; SMN2KDM4EHPGD
SCHEMBL11660474 0.75 IDO1 (0.54) IDO1MAPTKMT2AALDH1A1HPGD
SCHEMBL11326356 0.75 HPGD (0.57) IDO1ALDH1A1SMN1; SMN2HPGDPOLB
SCHEMBL11763230 0.74 PLK1 (0.51) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL10824330 0.73 IDO1 (0.47) IDO1TERTMAPTKMT2AMEN1
SCHEMBL11660980 0.73 HPGD (0.54) IDO1MAPTKMT2AMEN1ALDH1A1
SCHEMBL7628635 0.73 IDO1 (0.46) IDO1TERTMAPTKMT2AMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4282168-A FUNGICIDES PPG INDUSTRIES, INC. (US) 1981-08-04 — — US claimed
US-4282168-A FUNGICIDES PPG INDUSTRIES, INC. (US) 1981-08-04 — — US disclosed
US-4055657-A S-ARYL-N-ALKYL-THIOLCARBAMATES PPG INDUSTRIES, INC. (US) 1977-10-25 — — US disclosed
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