SCHEMBL742533

SCHEMBL742533

FC(F)(F)c1ccncn1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 1/20 0.46
▸ TRPV4 Q9HBA0 1/20 0.43
▸ HSP90AA1 P07900 1/20 0.42
▸ CA2 P00918 1/20 0.41
▸ CHKA P35790 1/20 0.41
▸ KIF11 P52732 1/20 0.39
▸ ABL1 P00519 1/20 0.37
▸ BCR P11274 1/20 0.37
▸ LOXL2 Q9Y4K0 3/20 0.36
▸ LOX P28300 1/20 0.35
▸ ADRB1 P08588 1/20 0.34
▸ TGFBR1 P36897 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ P2RX7 Q99572 1/20 0.32
▸ NOS3 P29474 1/20 0.31
▸ NOS2 P35228 1/20 0.31

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
SCHEMBL29563920 1.00 CYP19A1 (0.46) CYP19A1TRPV4HSP90AA1CA2CHKA
Hydrazine SCHEMBL4301523 0.95 HSP90AA1 (0.44) CYP19A1TRPV4HSP90AA1CA2CHKA
Piperazine SCHEMBL4824527 0.88 ADRB1 (0.46) CYP19A1TRPV4HSP90AA1CA2CHKA
Phenol SCHEMBL28808335 0.84 CYP19A1 (0.44) CYP19A1TRPV4HSP90AA1CA2CHKA
Butyl Chloride SCHEMBL27454449 0.82 CYP2D6 (0.40) CYP19A1TRPV4HSP90AA1CA2CHKA
SCHEMBL29628255 0.81 CYP19A1 (0.43) CYP19A1HSP90AA1CA2CHKAKIF11
SCHEMBL27581634 0.81 CYP19A1 (0.47) CYP19A1HSP90AA1CA2CHKAKIF11
SCHEMBL16454702 0.81 CYP19A1 (0.43) CYP19A1HSP90AA1CA2CHKAKIF11
SCHEMBL31691964 0.81 CYP19A1 (0.43) CYP19A1HSP90AA1CA2CHKAKIF11
SCHEMBL16454356 0.81 CYP19A1 (0.43) CYP19A1HSP90AA1CA2CHKAKIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4127157-B1 MODIFIED DIPEPTIDE CLEAVASES, USES THEREOF AND RELATED KITS ENCODIA INC (US) 2026-02-11 — — EP claimed
CN-119630645-A Flavivirus inhibitors IRBM股份公司 2025-03-14 — — CN claimed
CN-118406090-A Neutral triisocomplex iridium complex containing dithioformic acid derivative coordination, and preparation method and application thereof 深圳信息职业技术学院 2024-07-30 — — CN claimed
CN-117165078-A Cyanate resin with low dielectric loss suitable for winding forming process, preparation method and application 中国科学院宁波材料技术与工程研究所 2023-12-05 — — CN claimed
EP-4013751-A1 2-HYDROXYCYCLOALKANE-1-CARBAMOYL DERIVATIVES Idorsia Pharmaceuticals Ltd (CH) 2022-06-22 — — EP claimed
CN-109400988-A A kind of gasket seal and preparation method thereof 慈溪市春潮密封件有限公司 2019-03-01 — — CN claimed
CN-105593215-B 2, 4-or 4, 6-diaminopyrimidine compounds as IDH2 mutant inhibitors for the treatment of cancer 安吉奥斯医药品有限公司 2019-01-15 — — CN claimed
CN-109195965-A The inhibitor that WDR5 protein-protein combines 普罗佩纶治疗公司 2019-01-11 — — CN claimed
CN-104093716-B Biaryl ether sulfonamide compounds and its purposes as therapeutic agent 克赛农制药股份有限公司 2017-06-23 — — CN claimed
CN-105906569-A Preparation method of pyrimidine derivatives 杰达维(上海)医药科技发展有限公司 2016-08-31 — — CN claimed
US-20140128373-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2014-05-08 — — US claimed
CN-103517710-A Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC 2014-01-15 — — CN claimed
CN-102887860-A Preparation method of 4-chloro-6-trifluoromethylpyrimidine type compound SHANGHAI TITAN TECHNOLOGY CO LTD 2013-01-23 — — CN claimed
CN-100338058-C Novel indole derivatives LANDBECK AS H (DK) 2007-09-19 — — CN claimed
CN-1310909-C Novel heteroaryl derivatives, their prepn. and use LUNDBECK & CO AS H (DK) 2007-04-18 — — CN claimed
CN-1529703-A Novel indole derivatives H��¡�±������޹�˾ 2004-09-15 — — CN claimed
CN-1520410-A Novel heteroaryl derivatives, their prepn. and use H��¡�±������޹�˾ 2004-08-11 — — CN claimed
CN-1255042-A Diaryl ethers and processes for their preparation and herbicidal and desiccant compositions containing them ISK AMERICAS INC (US) 2000-05-31 — — CN claimed
EP-4743446-A1 NITRO-CONTAINING COMPOUNDS THAT KILL MYCOBACTERIA Board of Trustees of Michigan State University (US) 2026-05-20 — — EP disclosed
US-4474599-A 1-(Pyridyl)-1H-1,2,3-triazole derivatives, and use as herbicidal agents THE DOW CHEMICAL COMPANY (US) 1984-10-02 — — 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-20140128373-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K20, PRKACA, MAP3K13 CYP19A1 3508/4885TRPV4 4326/4885HSP90AA1 583/4885

“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.

Send feedback