SCHEMBL812229

SCHEMBL812229

FC1C2CC3CC(C2)CC1C3

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.44
EPHX2 P34913 1/20 0.33
HSD11B1 P28845 1/20 0.32
CYP2A13 Q16696 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 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
SCHEMBL7042809 0.76 CYP2C9 (0.32) CYP2C9
SCHEMBL14473237 0.72 CYP2C9 (0.40) CYP2C9EPHX2
Adamantane SCHEMBL12761 0.68 CYP2C9 (0.46) CYP2C9EPHX2HSD11B1
Adamantane SCHEMBL1527414 0.68 CYP2C9 (0.46) CYP2C9EPHX2HSD11B1
Adamantane SCHEMBL9016497 0.68 CYP2C9 (0.46) CYP2C9EPHX2HSD11B1
Adamantane SCHEMBL29707714 0.68 CYP2C9 (0.46) CYP2C9EPHX2HSD11B1
SCHEMBL2189873 0.67 CYP2C9 (0.50) CYP2C9EPHX2HSD11B1CYP2A13CA1
SCHEMBL22564399 0.67
SCHEMBL31497778 0.65
SCHEMBL13772063 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230200218-A1 LIGHT-EMITTING DEVICE INCLUDING AMINE COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, AND THE AMINE COMPOUND SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-22 US disclosed
US-20220024958-A1 LIGHT-EMITTING DEVICE AND ELECTRONIC APPARATUS INCLUDING SAME SAMSUNG DISPLAY CO., LTD. (KR) 2022-01-27 US disclosed
WO-2021131655-A1 ACTINIC-RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, ACTINIC-RAY-SENSITIVE OR RADIATION-SENSITIVE FILM, PATTERN FORMATION METHOD, AND ELECTRONIC DEVICE MANUFACTURING METHOD 富士フイルム株式会社 2021-07-01 WO disclosed
US-20200190012-A1 C-HALOGEN BOND FORMATION THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2020-06-18 US disclosed
US-20190127311-A1 C-HALOGEN BOND FORMATION THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2019-05-02 US disclosed
US-10196341-B2 C-halogen bond formation THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2019-02-05 US disclosed
US-20160264512-A1 C-HALOGEN BOND FORMATION THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2016-09-15 US disclosed
US-20160264512-A1 C-HALOGEN BOND FORMATION THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2016-09-15 US disclosed
EP-1903021-B1 PROCESS FOR PRODUCTION OF FLUOROCOMPOUNDS TOSOH F TECH INC (JP) 2015-09-30 EP disclosed
WO-2015054476-A1 C-HALOGEN BOND FORMATION THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2015-04-16 WO disclosed
EP-2189467-A2 Method of fluorination by microwaves Mitsubishi Gas Chemical Company, Inc. (JP) 2010-05-26 EP disclosed
US-7615669-B2 Process for producing fluoro-compounds TOSOH F-TECH, INC. (JP) 2009-11-10 US disclosed
US-20090099326-A1 FLUORINE-CONTAINING ADAMANTANE DERIVATIVE, FLUORINE-CONTAINING ADAMANTANE DERIVATIVE HAVING POLYMERIZABLE GROUP, RESIN COMPOSITION CONTAINING THE SAME, AND ANTIREFLECTION FILM IDEMITSU KOSAN CO., LTD. (JP) 2009-04-16 US disclosed
US-20090030228-A1 Process for producing fluoro-compounds TOSOH F-TECH, INC. (JP) 2009-01-29 US disclosed
US-20080319228-A1 Method of fluorination HARA SHOJI 2008-12-25 US disclosed
US-20080154064-A1 Method of fluorination HARA SHOJI 2008-06-26 US disclosed
US-7351863-B2 Method of fluorination MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2008-04-01 US disclosed
EP-1903021-A1 PROCESS FOR PRODUCTION OF FLUOROCOMPOUNDS Tosoh F-Tech, Inc. (JP) 2008-03-26 EP disclosed
US-20060014972-A1 Method of fluorination MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2006-01-19 US disclosed
EP-1568703-A1 METHOD OF FLUORINATION MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2005-08-31 EP 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 (10 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-20200190012-A1 C-HALOGEN BOND FORMATION CBR3, FOS, CBR1 CYP2C9 2225/4885EPHX2 1709/4885HSD11B1 1570/4885
US-20220024958-A1 LIGHT-EMITTING DEVICE AND ELECTRONIC APPARATUS INCLUDING SAME CRY1, LAGE3, CYBA CYP2C9 635/4885EPHX2 665/4885HSD11B1 2237/4885
US-20160264512-A1 C-HALOGEN BOND FORMATION FOS, BCL3, CBR3 CYP2C9 2601/4885EPHX2 2738/4885HSD11B1 2645/4885
US-20080154064-A1 Method of fluorination FUCA2, FABP2, FGB CYP2C9 3538/4885EPHX2 392/4885HSD11B1 2886/4885
US-20090099326-A1 FLUORINE-CONTAINING ADAMANTANE DERIVATIVE, FLUORINE-CONTAINING ADAMANTANE DERIVATIVE HAVING POLYMERIZABLE GROUP, RESIN COMPOSITION CONTAINING THE SAME, AND ANTIREFLECTION FILM ADGRF1, RFT1, AFF1 CYP2C9 2325/4885EPHX2 1783/4885HSD11B1 1090/4885
US-20230200218-A1 LIGHT-EMITTING DEVICE INCLUDING AMINE COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, AND THE AMINE COMPOUND SLC18A1, CRY1, AADAT CYP2C9 206/4885EPHX2 297/4885HSD11B1 2164/4885
US-20190127311-A1 C-HALOGEN BOND FORMATION CBR3, FOS, CBR1 CYP2C9 2225/4885EPHX2 1709/4885HSD11B1 1570/4885
US-20080319228-A1 Method of fluorination FUCA2, FABP2, FGB CYP2C9 3538/4885EPHX2 392/4885HSD11B1 2886/4885
US-10196341-B2 C-halogen bond formation CBR3, FOS, CBR1 CYP2C9 2225/4885EPHX2 1709/4885HSD11B1 1570/4885
US-20060014972-A1 Method of fluorination FUCA2, FABP2, FGB CYP2C9 3538/4885EPHX2 392/4885HSD11B1 2886/4885

“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.