SCHEMBL487041

SCHEMBL487041

Cc1cc(O)cc(C)c1[N+](=O)[O-]

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.54
TDP1 Q9NUW8 2/20 0.54
CYTH2 Q99418 1/20 0.46
GPR35 Q9HC97 2/20 0.45
CYP3A4 P08684 2/20 0.42
ALOX15 P16050 2/20 0.42
CHRM1 P11229 1/20 0.42
MAOA P21397 1/20 0.42
TBXA2R P21731 1/20 0.42
ADRA1A P35348 1/20 0.42
HTR2B P41595 1/20 0.42
GRIN2D O15399 1/20 0.42
GRIN3B O60391 1/20 0.42
GRIN1 Q05586 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2B Q13224 1/20 0.42
GRIN2C Q14957 1/20 0.42
GRIN3A Q8TCU5 1/20 0.42
TSHR P16473 4/20 0.42
MCL1 Q07820 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
Formaldehyde SCHEMBL28712793 0.96 ALDH1A1 (0.50) ALDH1A1TDP1CYTH2GPR35CYP3A4
SCHEMBL1285396 0.89 CYP3A4 (0.44) ALDH1A1TDP1CYTH2GPR35CYP3A4
SCHEMBL22995882 0.82 PKM (0.44) ALDH1A1TDP1CYTH2CYP3A4ALOX15
SCHEMBL9651424 0.82 PKM (0.47) ALDH1A1TDP1CYTH2GPR35CYP3A4
SCHEMBL10387706 0.82 PKM (0.47) ALDH1A1TDP1CYTH2GPR35CYP3A4
SCHEMBL27668581 0.81 CYTH2 (0.38) ALDH1A1TDP1CYTH2GPR35CYP3A4
SCHEMBL1820951 0.80 ALDH1A1 (0.58) ALDH1A1TDP1GPR35CYP3A4GRIN2D
SCHEMBL11576039 0.80 PTPN1 (0.42) ALDH1A1TDP1CYTH2GPR35CYP3A4
SCHEMBL15203544 0.78 SMN1; SMN2 (0.49) ALDH1A1CYTH2CYP3A4KMT2APOLB
SCHEMBL8440730 0.78 TSHR (0.58) ALDH1A1TDP1GPR35CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118479968-A Synthesis process of 3, 5-dimethyl-4-nitrophenol 镇江中智化学科技有限公司 2024-08-13 CN claimed
EP-3980770-B1 INDICATOR MATERIAL COMPRISING A POLYMERIC GEL CARRIER AND POLYMERIC INDICATOR MOOW FARM KFT (HU) 2024-01-24 EP claimed
US-20220404323-A1 INDICATOR MATERIAL COMPRISING A POLYMERIC GEL CARRIER AND POLYMERIC INDICATOR MOOW.FARM KFT. (HU) 2022-12-22 US claimed
EP-3980770-A1 INDICATOR MATERIAL COMPRISING A POLYMERIC GEL CARRIER AND POLYMERIC INDICATOR MOOW.FARM KFT. (HU) 2022-04-13 EP claimed
CN-114174811-A Indicator material comprising a polymeric gel carrier and a polymeric indicator 穆尔农业公司 2022-03-11 CN claimed
WO-2020245616-A1 INDICATOR MATERIAL COMPRISING A POLYMERIC GEL CARRIER AND POLYMERIC INDICATOR MOOW.FARM KFT. (HU) 2020-12-10 WO claimed
CN-120590280-A Preparation method of 3, 5-dimethyl-4-nitrophenol 浙江中科创越药业有限公司 2025-09-05 CN disclosed
CN-120590280-A Preparation method of 3, 5-dimethyl-4-nitrophenol 浙江中科创越药业有限公司 2025-09-05 CN disclosed
CN-120118068-A Chemical process for preparing phenylpiperidinyl indole derivatives 诺华股份有限公司 2025-06-10 CN disclosed
CN-112513025-B Chemical process for preparing phenylpiperidinyl indole derivatives 诺华股份有限公司 2025-03-25 CN disclosed
WO-2024177127-A1 SUBSTITUTED PYRAZOLOPYRIMIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF 日本たばこ産業株式会社 2024-08-29 WO disclosed
US-20240287079-A1 6-AMINOPYRAZOLOPYRIMIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF JAPAN TOBACCO INC. (JP) 2024-08-29 US disclosed
CN-118479968-A Synthesis process of 3, 5-dimethyl-4-nitrophenol 镇江中智化学科技有限公司 2024-08-13 CN disclosed
US-4236007-A YELLOW SHADES ON POLYESTERS CIBA-GEIGY AKTIENGESELLSCHAFT (CH) 1980-11-25 US disclosed
US-4180665-A Substituted 3-benz(cd)indol-2-(1H)-ylidene-furo[2,3-b]quinoxalin-2(3H)one dyestuffs CIBA-GEIGY AKTIENGESELLSCHAFT (CH) 1979-12-25 US disclosed
US-4159379-A Dispersion dyestuffs of the naphtholactam series CIBA-GEIGY AG (CH) 1979-06-26 US disclosed
US-4148805-A POLYESTERS, RED, YELLLOW CIBA-GEIGY AG (CH) 1979-04-10 US disclosed
US-4146541-A YELLOW SHADE ON POLYESTERS CIBA-GEIGY AG (CH) 1979-03-27 US disclosed
US-4104269-A Methoxymethoxy protected intermediates for photographic dyes POLAROID CORPORATION (US) 1978-08-01 US disclosed
US-4035401-A Intermediates for photographic dyes POLAROID CORPORATION (US) 1977-07-12 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 (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-20240287079-A1 6-AMINOPYRAZOLOPYRIMIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF NLRP3, NLRP1, NOD1 ALDH1A1 1141/4885TDP1 1245/4885CYTH2 1099/4885

“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.