SCHEMBL297864

SCHEMBL297864

CNCc1cccc(Cl)c1

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.66
CHRM2 P08172 1/20 0.58
PNMT P11086 2/20 0.54
NOS1 P29475 1/20 0.53
PRMT6 Q96LA8 3/20 0.53
CARM1 Q86X55 2/20 0.53
CYP3A4 P08684 3/20 0.52
KDM4E B2RXH2 1/20 0.52
MAPT P10636 1/20 0.52
SOS1 Q07889 1/20 0.50
IDO1 P14902 1/20 0.48
AGXT P21549 1/20 0.48
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
HTR2A P28223 1/20 0.47
SLC6A4 P31645 1/20 0.47
KCNH2 Q12809 1/20 0.47

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
SCHEMBL29585400 1.00 TAAR1 (0.66) TAAR1CHRM2PNMTNOS1PRMT6
SCHEMBL1697126 0.84 MAPT (0.64) TAAR1NOS1PRMT6CYP3A4KDM4E
SCHEMBL19069756 0.83 TAAR1 (0.56) TAAR1CHRM2PNMTPRMT6CARM1
SCHEMBL7066938 0.82 CHRM2 (0.74) TAAR1CHRM2PNMTCYP3A4IDO1
Hydrochloric Acid SCHEMBL3273205 0.81 MAPT (0.68) NOS1PRMT6CYP3A4KDM4EMAPT
SCHEMBL30656906 0.80 CHRM2 (0.60) TAAR1CHRM2PNMTCYP3A4IDO1
SCHEMBL27908406 0.80 CHRM2 (0.60) TAAR1CHRM2PNMTCYP3A4IDO1
SCHEMBL29868670 0.79 CHRM2 (0.65) TAAR1CHRM2PNMTCYP3A4CYP1A2
SCHEMBL1108512 0.79 TAAR1 (1.00) TAAR1CHRM2PNMTPRMT6CARM1
SCHEMBL3514622 0.79 CHRM2 (0.65) TAAR1CHRM2PNMTCYP3A4CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119118878-A Paeonol carbamate compound, pharmaceutical preparation, preparation method and application 安徽省第二人民医院(安徽医学高等专科学校附属医院、安徽省职业病防治院) 2024-12-13 CN claimed
CN-116283769-A Cyclobutane-pyridine sulfonamide compound 绍兴市上虞区武汉理工大学高等研究院 2023-06-23 CN claimed
CN-112279786-A Cannabidiol carbamate compound, pharmaceutical preparation, preparation method and application 汤文建 2021-01-29 CN claimed
CN-1832928-B 5-membered heterocycle-based p38 kinase inhibitors NOVARTIS AG (CH) 2012-07-04 CN claimed
JP-4838121-B2 2011-12-14 JP claimed
EP-1641764-B1 5-MEMBERED HETEROCYCLE-BASED P38 KINASE INHIBITORS NOVARTIS AG (CH) 2011-07-27 EP claimed
EP-2298743-A1 5-membered heterocycle-based P38 kinase inhibitors Novartis AG (CH) 2011-03-23 EP claimed
EP-2006271-A9 SUBSTITUTED BICYCLIC CYCLIC DERIVATIVE AND USE THEREOF Asahi Kasei Pharma Corporation (JP) 2009-07-29 EP claimed
CN-101410366-A Substituted bicyclic ring derivatives and uses thereof ASAHI KASEI PHARMA CORP (JP) 2009-04-15 CN claimed
US-20090054401-A1 Substituted bicyclic derivatives and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2009-02-26 US claimed
US-20080200454-A1 CARBON-LINKED TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S SUNESIS PHARMACEUTICALS, INC. 2008-08-21 US claimed
JP-2007521278-A 2007-08-02 JP claimed
CN-1832928-A 5-membered heterocycle-based p38 kinase inhibitors NOVARTIS AG (CH) 2006-09-13 CN claimed
EP-1641764-A1 5-MEMBERED HETEROCYCLE-BASED P38 KINASE INHIBITORS Novartis AG (CH) 2006-04-05 EP claimed
US-6967216-B2 Amino substituted dibenzothiophene derivatives for the treatment of disorders mediated by NP Y5 receptor ASTRAZENECA AB (SE) 2005-11-22 US claimed
US-20050049288-A1 5-MEMBERED HETEROCYCLE-BASED p38 KINASE INHIBITORS MEREO BIOPHARMA 1 LIMINTED (GB) 2005-03-03 US claimed
WO-2005009973-A1 5-MEMBERED HETEROCYCLE-BASED P38 KINASE INHIBITORS NOVARTIS AG (CH) 2005-02-03 WO claimed
US-20030225097-A1 Amino substituted dibenzothiophene derivatives for the treatment of disorders mediated by np y5 receptor ASTRAZENECA AB (SE) 2003-12-04 US claimed
EP-1278739-A1 AMINO SUBSTITUTED DIBENZOTHIOPHENE DERIVATIVES FOR THE TREATMENT OF DISORDERS MEDIATED BY THE NP Y5 RECEPTOR AstraZeneca AB (SE) 2003-01-29 EP claimed
WO-2001085714-A1 AMINO SUBSTITUTED DIBENZOTHIOPHENE DERIVATIVES FOR THE TREATMENT OF DISORDERS MEDIATED BY THE NP Y5 RECEPTOR ASTRAZENECA AB (SE) 2001-11-15 WO 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 (4 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-20090054401-A1 Substituted bicyclic derivatives and use thereof LTB4R2, LTC4S, LTB4R TAAR1 1127/4885CHRM2 553/4885PNMT 3102/4885
US-20050049288-A1 5-MEMBERED HETEROCYCLE-BASED p38 KINASE INHIBITORS MAPK1, MAP3K1, MAP3K8 TAAR1 2016/4885CHRM2 4584/4885PNMT 4261/4885
US-20080200454-A1 CARBON-LINKED TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S CTSS, CTSK, CTSZ TAAR1 3251/4885CHRM2 3164/4885PNMT 3898/4885
US-20030225097-A1 Amino substituted dibenzothiophene derivatives for the treatment of disorders mediated by np y5 receptor NPY5R, NPY1R, NPY2R TAAR1 104/4885CHRM2 1185/4885PNMT 97/4885

“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.