SCHEMBL2914537

SCHEMBL2914537

CC=NC(=O)Nc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NAPRT Q6XQN6 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.50
▸ TP53 P04637 1/20 0.50
▸ EPHX1 P07099 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ EPHX2 P34913 1/20 0.50
▸ CDK9 P50750 1/20 0.50
▸ CLK4 Q9HAZ1 1/20 0.50
▸ CYP1A2 P05177 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ TGM2 P21980 1/20 0.47
▸ MAPT P10636 3/20 0.46
▸ GAA P10253 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ SCN1A P35498 1/20 0.46
▸ SCN2A Q99250 1/20 0.46
▸ SCN3A Q9NY46 1/20 0.46

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
SCHEMBL28044354 0.82 TDP1 (0.53) SMN1; SMN2TGM2MAPTNPC1RAB9A
SCHEMBL28864409 0.79 SAE1 (0.47) SMN1; SMN2TSHRMAPTALDH1A1LMNA
SCHEMBL9188901 0.79 RAB9A (0.54) HSD17B10SMN1; SMN2TP53CYP1A2MAPT
SCHEMBL19145310 0.78 SMN1; SMN2 (0.44) NAPRTHSD17B10SMN1; SMN2TP53EPHX1
SCHEMBL897272 0.77 HSD17B10 (0.58) NAPRTHSD17B10SMN1; SMN2TP53EPHX1
SCHEMBL11183534 0.77 MTOR (0.47) NAPRTHSD17B10SMN1; SMN2TP53EPHX1
SCHEMBL11650361 0.76 EPHX2 (0.61) NAPRTHSD17B10SMN1; SMN2TP53EPHX1
SCHEMBL10457010 0.76 EPHX2 (0.61) NAPRTHSD17B10SMN1; SMN2TP53EPHX1
SCHEMBL13513997 0.75 NPC1 (0.53) NAPRTHSD17B10SMN1; SMN2TP53EPHX1
SCHEMBL3175598 0.74 SMN1; SMN2 (0.58) NAPRTHSD17B10SMN1; SMN2TP53EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104159478-B Continuous multilayer film and manufacturing method thereof 3M创新有限公司 2017-07-25 — — CN disclosed
EP-1438073-B1 POLYOXYALKYLENE CONJUGATES AS ENZYME INHIBITORS PROCTER & GAMBLE (US) 2010-08-11 — — EP disclosed
EP-1212097-B1 ENZYME INHIBITORS PROCTER & GAMBLE (US) 2005-11-16 — — EP disclosed
EP-1438073-A2 POLYOXYALKYLENES CONJUGATES AS ENZYME INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2004-07-21 — — EP disclosed
US-6723788-B1 Enzyme inhibitors THE PROCTER & GAMBLE COMPANY 2004-04-20 — — US disclosed
US-6541629-B1 An enzyme inhibitor containing benzoxazine ring attached with 1-16 ethoxy groups used for treating diaper rash THE PROCTER & GAMBLE COMPANY 2003-04-01 — — US disclosed
EP-1212098-A2 ENZYME INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2002-06-12 — — EP disclosed
WO-2001017565-A2 POLYOXYALKYLENES CONJUGATES AS ENZYME INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2001-03-15 — — WO disclosed
WO-2001018181-A2 ENZYME INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2001-03-15 — — WO disclosed
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