SCHEMBL11183534

SCHEMBL11183534

CC=NC(=O)N(C)C(=O)Nc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 2/20 0.47
▸ ATM Q13315 1/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ HSD17B10 Q99714 2/20 0.44
▸ NAPRT Q6XQN6 1/20 0.44
▸ NPSR1 Q6W5P4 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ TP53 P04637 2/20 0.42
▸ TSHR P16473 2/20 0.42
▸ EPHX1 P07099 1/20 0.42
▸ EPHX2 P34913 1/20 0.42
▸ CDK9 P50750 1/20 0.42
▸ CLK4 Q9HAZ1 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ RAB9A P51151 3/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ TGM2 P21980 1/20 0.41

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
SCHEMBL11212533 0.78 MTOR (0.56) MTORATMSMN1; SMN2MEN1KMT2A
SCHEMBL2914537 0.77 NAPRT (0.52) ATMSMN1; SMN2KMT2AHSD17B10NAPRT
SCHEMBL897011 0.77 MTOR (0.54) MTORATMSMN1; SMN2MEN1KMT2A
Hydrochloric Acid SCHEMBL11683253 0.77 ALDH1A1 (0.55) MTORATMSMN1; SMN2MEN1KMT2A
SCHEMBL11264594 0.75 MTOR (0.46) MTORATMSMN1; SMN2MEN1KMT2A
SCHEMBL11264598 0.75 MTOR (0.46) MTORATMSMN1; SMN2MEN1KMT2A
SCHEMBL11263561 0.75 MTOR (0.53) MTORATMSMN1; SMN2MEN1KMT2A
Acetone SCHEMBL11758877 0.75 HSD17B10 (0.55) MTORATMSMN1; SMN2MEN1KMT2A
SCHEMBL10359100 0.75 MTOR (0.53) MTORATMSMN1; SMN2MEN1KMT2A
SCHEMBL11264976 0.75 MTOR (0.53) MTORATMSMN1; SMN2MEN1KMT2A

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-4371544-A ANTIINFLAMMATORY AGENTS, ANALGESTICS TAIHO PHARMACEUTICAL COMPANY LIMITED (JP) 1983-02-01 — — US disclosed
US-4278672-A ANALGESICS, ANTIINFLAMMATORY AGENTS TAIHO PHARMACEUTICAL COMPANY, LIMITED (JP) 1981-07-14 — — US disclosed
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