SCHEMBL11273443

SCHEMBL11273443

CN(C(=O)Nc1ccccc1)C(=O)NC(C)(C)C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTOR P42345 2/20 0.49
ATM Q13315 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MAPT P10636 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
GAA P10253 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
HPGD P15428 1/20 0.46
ALOX12 P18054 1/20 0.46
CYP2C19 P33261 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
NAPRT Q6XQN6 1/20 0.46
HSD17B10 Q99714 1/20 0.46
NPSR1 Q6W5P4 1/20 0.45
KCNJ6 P48051 1/20 0.44

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
SCHEMBL11263561 0.80 MTOR (0.53) MTORATMMEN1KMT2AALDH1A1
SCHEMBL11262218 0.80 MTOR (0.53) MTORATMMEN1KMT2AALDH1A1
SCHEMBL11212533 0.80 MTOR (0.56) MTORATMMEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL11683253 0.78 ALDH1A1 (0.55) MTORATMMEN1KMT2AALDH1A1
SCHEMBL897011 0.78 MTOR (0.54) MTORATMMEN1KMT2AALDH1A1
SCHEMBL11266248 0.78 MEN1 (0.45) MTORATMMEN1KMT2AALDH1A1
SCHEMBL11279087 0.77 NAPRT (0.57) MTORATMMEN1KMT2AALDH1A1
SCHEMBL7659114 0.77 MTOR (0.50) MTORATMMEN1KMT2AALDH1A1
Acetone SCHEMBL11758877 0.77 HSD17B10 (0.55) MTORATMMEN1KMT2AALDH1A1
SCHEMBL10599760 0.77 MTOR (0.53) MTORATMMEN1KMT2AALDH1A1

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
US-4350700-A ANALGESIC, ANTIINFLAMMATORY, ANTIPYRETIC TAIHO PHARMACEUTICAL COMPANY, LIMITED (JP) 1982-09-21 US disclosed
US-4287207-A USED AS AN ANALGESIC, ANTIPYRETIC OR ANTIINFLAMMATORY AGENT TAIHO PHARMACEUTICAL COMPANY, LIMITED (JP) 1981-09-01 US disclosed