SCHEMBL5523767

SCHEMBL5523767

Cc1cc(C)cc(NC(N)=O)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
KIF11 P52732 1/20 0.55
MAPT P10636 3/20 0.52
GAA P10253 1/20 0.52
NPSR1 Q6W5P4 2/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
HTT P42858 1/20 0.52
THRB P10828 1/20 0.52
LMNA P02545 2/20 0.50
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
HDAC3 O15379 1/20 0.48
HDAC4 P56524 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC7 Q8WUI4 1/20 0.48
HDAC2 Q92769 1/20 0.48

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
SCHEMBL5987435 0.87 LMNA (0.50) CYP1A2CYP3A4KIF11MAPTGAA
Trifluoroacetic Acid SCHEMBL5031436 0.87 CYP1A2 (0.47) CYP1A2CYP3A4KIF11MAPTGAA
SCHEMBL5453986 0.86 KIF11 (0.47) CYP1A2CYP3A4KIF11MAPTGAA
SCHEMBL1787750 0.82 PEPD (0.56) KIF11MAPTGAAMEN1KMT2A
SCHEMBL31356653 0.81 MAPT (0.57) KIF11MAPTLMNACA12CA1
SCHEMBL30801673 0.81 KIF11 (0.50) CYP1A2CYP3A4KIF11MAPTGAA
SCHEMBL27923493 0.80 MEN1 (0.73) MAPTGAANPSR1MEN1KMT2A
SCHEMBL93283 0.80 NPSR1 (0.55) CYP1A2CYP3A4MAPTGAANPSR1
SCHEMBL27524136 0.80 KIF11 (0.76) KIF11MAPTGAAMEN1KMT2A
SCHEMBL10271728 0.79 CYP1A2 (0.51) CYP1A2CYP3A4MAPTGAANPSR1

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 80 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103517934-A Epoxy resin composition for fiber-reinforced composite material YOKOHAMA RUBBER CO LTD 2014-01-15 CN claimed
CN-100475793-C Quinazoline derivatives and use for preparing medicine TAISHO PHARMACEUTICAL CO LTD (JP) 2009-04-08 CN claimed
CN-1795180-A Novel quinazoline derivatives and methods of treatment related to the use thereof TAISHO PHARMACEUTICAL CO LTD (JP) 2006-06-28 CN claimed
CN-1784236-A Androgen receptor modulators and methods of use thereof MERCK & CO INC (US) 2006-06-07 CN claimed
CN-1406110-A Enhancement of seed/fruit/nut yield from flowering plants UNIROYAL CHEM CO INC (US) 2003-03-26 CN claimed
CN-1379668-A 3(5)-ureido-pyrazole derivatives, process for their preparation and their use as antitumor agents PHARMACIA & UPJOHN SPA (IT) 2002-11-13 CN claimed
CN-1325390-A 2-ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents PHARMACIA & UPJOHN SPA (IT) 2001-12-05 CN claimed
CN-117003802-B Sulfonamide derivative containing glucosamine as well as preparation method and application thereof 沈阳药科大学 2024-08-13 CN disclosed
CN-117003802-A Sulfonamide derivative containing glucosamine as well as preparation method and application thereof 沈阳药科大学 2023-11-07 CN disclosed
EP-3616753-A1 COMPOUNDS FOR MODULATING ADENOSINE A2B RECEPTOR AND ADENOSINE A2A RECEPTOR Corvus Pharmaceuticals, Inc. (US) 2020-03-04 EP disclosed
CN-107428913-B Improve the hardening resin composition containing polymer particles of impact resistance removing cementability 株式会社钟化 2019-10-18 CN disclosed
CN-107266338-B The manufacturing method of isocyanates 旭化成株式会社 2019-10-11 CN disclosed
CN-109843963-A Isocyanate composition, method for producing isocyanate polymer, and isocyanate polymer 旭化成株式会社 2019-06-04 CN disclosed
WO-2004113304-A1 INDAZOLE, BENZISOXAZOLE, AND BENZISOTHIAZOLE KINASE INHIBITORS ABBOTT LABORATORIES (US) 2004-12-29 WO disclosed
CN-1543459-A Quinoline derivative and quinazoline derivative having azolyl group ������������ʽ���� 2004-11-03 CN disclosed
CN-1525957-A Antipicornaviral compounds and compositions, their pharmaceutical uses, and materials for their synthesis ������ҩ�����޹�˾ 2004-09-01 CN disclosed
CN-1406110-A Enhancement of seed/fruit/nut yield from flowering plants UNIROYAL CHEM CO INC (US) 2003-03-26 CN disclosed
CN-1379668-A 3(5)-ureido-pyrazole derivatives, process for their preparation and their use as antitumor agents PHARMACIA & UPJOHN SPA (IT) 2002-11-13 CN disclosed
CN-1325390-A 2-ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents PHARMACIA & UPJOHN SPA (IT) 2001-12-05 CN disclosed
CN-1243511-A Preparation of -3,4-dicarboxylic anhydrides CIBA SC HOLDING AG (CH) 2000-02-02 CN disclosed