SCHEMBL2007282

SCHEMBL2007282

Cc1ccc(NC([NH])=O)cc1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.64
POLB P06746 2/20 0.61
TGM2 P21980 1/20 0.61
NPC1 O15118 4/20 0.59
RAB9A P51151 3/20 0.59
KIF11 P52732 1/20 0.55
KDM4E B2RXH2 1/20 0.55
MAPT P10636 3/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
NMT1 P30419 1/20 0.52
DDAH1 O94760 1/20 0.50
ALDH1A1 P00352 1/20 0.50
PKM P14618 1/20 0.50

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
SCHEMBL6850999 0.80 KDM4E (0.79) TDP1POLBTGM2NPC1RAB9A
SCHEMBL455439 0.80 TDP1 (0.70) TDP1POLBTGM2NPC1RAB9A
SCHEMBL1275920 0.80 ALDH1A1 (0.70) TDP1POLBNPC1RAB9AKDM4E
SCHEMBL7921886 0.78 MAPT (0.60) NPC1RAB9AKDM4EMAPTALDH1A1
SCHEMBL2093333 0.78 TDP1 (0.67) TDP1POLBTGM2NPC1RAB9A
SCHEMBL61417 0.78 TDP1 (1.00) TDP1POLBNPC1RAB9AKDM4E
Fluoride SCHEMBL11790965 0.78 TDP1 (0.67) TDP1POLBTGM2NPC1RAB9A
SCHEMBL6358702 0.77 MAPT (0.60) POLBNPC1RAB9AMAPTSMN1; SMN2
SCHEMBL2912453 0.77 RAB9A (0.80) TDP1POLBNPC1RAB9AKDM4E
SCHEMBL81433 0.76 KIF11 (0.88) TDP1POLBTGM2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2651879-B1 ENANTIOMERICALLY PURE BINAPHTHOL DERIVATIVES AND METHOD FOR PREPARING THE SAME AMINOLOGICS CO LTD (KR) 2018-03-07 EP claimed
US-9198426-B2 Use of 5 pyridin-4-yl-1,3-thiazoles for controlling phytopathogenic fungi BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-12-01 US claimed
US-20140012038-A1 ENANTIOMERICALLY PURE BINAPHTHOL DERIVATIVES AND METHOD FOR PREPARING THE SAME AMINOLOGICS CO., LTD. (KR) 2014-01-09 US claimed
EP-2651879-A2 ENANTIOMERICALLY PURE BINAPHTHOL DERIVATIVES AND METHOD FOR PREPARING THE SAME Aminologics Co., Ltd (KR) 2013-10-23 EP claimed
WO-2012081885-A2 ENANTIOMERICALLY PURE BINAPHTHOL DERIVATIVES AND METHOD FOR PREPARING THE SAME AMINOLUX, INC. (KR) 2012-06-21 WO claimed
EP-2378880-A1 USE OF 5-PYRIDIN-4YL(1,3)THIAZOLE FOR TREATING PHYTOPATHOGENIC FUNGI BAYER CROPSCIENCE AG (DE) 2011-10-26 EP claimed
US-20100168185-A1 Use of 5-pyridin-4-yl-1,3-thiazoles for controlling phytopathogenic fungi BAYER CORPSCIENCE AG (DE) 2010-07-01 US claimed
WO-2010069494-A1 USE OF 5-PYRIDIN-4YL(1,3)THIAZOLE FOR TREATING PHYTOPATHOGENIC FUNGI BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-06-24 WO claimed
EP-2198710-A1 Use of 5-pyridin-4yl-(1,3) thiazoles for combating phytopathogenic fungi Bayer CropScience AG (DE) 2010-06-23 EP claimed
US-9198426-B2 Use of 5 pyridin-4-yl-1,3-thiazoles for controlling phytopathogenic fungi BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-12-01 US disclosed
EP-1932841-B1 SULFONAMIDE COMPOUND ASAHI KASEI PHARMA CORP (JP) 2014-01-01 EP disclosed
US-8415372-B2 Sulfonamide compound ASAHI KASEI PHARMA CORPORATION (JP) 2013-04-09 US disclosed
EP-2378880-A1 USE OF 5-PYRIDIN-4YL(1,3)THIAZOLE FOR TREATING PHYTOPATHOGENIC FUNGI BAYER CROPSCIENCE AG (DE) 2011-10-26 EP disclosed
US-7964613-B2 (S)-3-amino-1-(4-bromo-5-isoquinolinesulfonyl)pyrrolidine; inhibits phosphorylation of myosin regulatory light chain; for spinal canal stenosis, spinal cord injury, rheumatoid arthritis, multiple sclerosis; Rho kinase inhibitors ASAHI KASEI PHARMA CORPORATION (JP) 2011-06-21 US disclosed
US-20060205594-A1 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. 2006-09-14 US disclosed
US-4775757-A CARDIOTONIC AND RENAL VASODILATING AGENTS ORTHO PHARMACEUTICAL CORPORATION (US) 1988-10-04 US disclosed
US-4065395-A Aryl diurea-thickened greases GULF RESEARCH & DEVELOPMENT COMPANY (US) 1977-12-27 US disclosed
US-4022799-A DYEING, PRINTING OF NATURAL AND SYNTHETIC MATERIALS BAYER AKTIENGESELLSCHAFT (DT) 1977-05-10 US disclosed
US-4001253-A NAPHTHOLACTAM DYESTUFFS BAYER AKTIENGESELLSCHAFT (DT) 1977-01-04 US disclosed
US-3950347-A NAPHTHOLACTAM DYESTUFFS BAYER AKTIENGESELLSCHAFT (DT) 1976-04-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100168185-A1 Use of 5-pyridin-4-yl-1,3-thiazoles for controlling phytopathogenic fungi PIR, PNPO, PDXK TDP1 1604/4885POLB 4343/4885TGM2 1102/4885
US-20140012038-A1 ENANTIOMERICALLY PURE BINAPHTHOL DERIVATIVES AND METHOD FOR PREPARING THE SAME ALDH1A1, ALDH7A1, ALDH3A1 TDP1 3302/4885POLB 1613/4885TGM2 758/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.