SCHEMBL834716

SCHEMBL834716

CC(=O)[N]c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 2/20 0.48
NOS1 P29475 2/20 0.48
MAPT P10636 4/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
NPC1 O15118 1/20 0.45
TRPA1 O75762 1/20 0.43
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
CRHR1 P34998 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HSD17B10 Q99714 2/20 0.41
NAPRT Q6XQN6 1/20 0.41
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
POLB P06746 2/20 0.40
CYP2D6 P10635 2/20 0.40

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
SCHEMBL4993304 0.78 TRPA1 (0.46) NOS3NOS1MAPTRAB9ASMN1; SMN2
SCHEMBL342606 0.78 TRPA1 (0.46) NOS3NOS1MAPTRAB9ASMN1; SMN2
SCHEMBL5699982 0.77 TDP1 (0.54) MAPTRAB9ASMN1; SMN2NPC1CES2
SCHEMBL5470032 0.77 AKR1C3 (0.51) MAPTRAB9AALDH1A1POLBCYP2D6
SCHEMBL7438431 0.77 HPGD (0.42) NOS3NOS1MAPTRAB9ASMN1; SMN2
SCHEMBL10697128 0.77 NOS3 (0.50) NOS3NOS1MAPTRAB9ASMN1; SMN2
Azobenzene SCHEMBL29154401 0.76 ALDH1A1 (0.67) NOS3NOS1MAPTRAB9ASMN1; SMN2
SCHEMBL4829863 0.76 TRPA1 (0.44) NOS3NOS1MAPTRAB9ASMN1; SMN2
SCHEMBL10376096 0.75 MAPT (0.52) NOS3NOS1MAPTRAB9ASMN1; SMN2
SCHEMBL10509447 0.75 PLG (0.43) NOS3NOS1SMN1; SMN2ALDH1A1NAPRT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114437046-A 5-fluorouracil spliced 4-aniline quinazoline compound and preparation method and application thereof 遵义医药高等专科学校 2022-05-06 CN claimed
CN-114437161-A Zidovudine spliced 4-aniline quinazoline compound as well as preparation method and application thereof 遵义医药高等专科学校 2022-05-06 CN 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
EP-1962830-B1 AZAINDOLE INHIBITORS OF AURORA KINASES GLAXOSMITHKLINE LLC (US) 2013-03-27 EP 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-7495102-B2 Azaindole inhibitors of aurora kinases SMITHKLINE BEECHAM CORPORATION (US) 2009-02-24 US claimed
EP-1962830-A2 AZAINDOLE INHIBITORS OF AURORA KINASES SmithKline Beecham Corporation (US) 2008-09-03 EP claimed
US-H122-H PYRAZOLOAZOLE-TYPE MAGENTA COUPLER DISPERSED IN A HIGH-BOILING PHOSPHATE SOLVENT FUJI PHOTO FILM CO., LTD. (JP) 1986-09-02 US claimed
US-4587207-A A-ACYL-A-PHENOXYACETANILIDE TYPE YELLOW COUPLER HAVING AN M-SULFAMOLY GROUP FUJI PHOTO FILM CO., LTD. (JP) 1986-05-06 US claimed
EP-0170164-A2 Silver halide color photographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 1986-02-05 EP claimed
EP-0001841-B1 TYLOSIN DERIVATIVES SANRAKU-OCEAN CO., LTD. (JP) 1982-12-01 EP claimed
US-4293691-A Method for preparing magenta couplers having thioether groups FUJI PHOTO FILM CO., LTD. (JP) 1981-10-06 US claimed
US-4218557-A PROTECTIVE COATINGS, MOLDINGS, FOAMS THE FIRESTONE TIRE & RUBBER COMPANY (US) 1980-08-19 US claimed
US-4205163-A Tylosin derivatives SANRAKU-OCEAN CO., LTD. (JP) 1980-05-27 US claimed
EP-0010231-A1 Polyphosphazene polymers containing N-substituted amido and imido substituents and process for their preparation THE FIRESTONE TIRE & RUBBER COMPANY (US) 1980-04-30 EP claimed
EP-0001841-A2 Tylosin derivatives SANRAKU-OCEAN CO., LTD. (JP) 1979-05-16 EP claimed
US-4122089-A Aminothiofluoran compounds, process for the production thereof, and recording elements containing the same SANKIO CHEMICAL CO., LTD. (JP) 1978-10-24 US claimed

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

For each of this compound's patents that has machine-readable text (1 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 NOS3 1470/4885NOS1 2345/4885MAPT 711/4885

“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.