SCHEMBL862486

SCHEMBL862486

Cc1ccc2cc(C)c(C)nc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.56
CYP1A2 P05177 4/20 0.56
KDM4E B2RXH2 4/20 0.50
HSD17B10 Q99714 2/20 0.50
TSHR P16473 2/20 0.49
ALOX15 P16050 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
KMT2A Q03164 3/20 0.47
NPSR1 Q6W5P4 1/20 0.47
CYP2A6 P11509 2/20 0.46
MAPT P10636 3/20 0.46
NCK1 P16333 1/20 0.45
BACE1 P56817 1/20 0.45
NQO2 P16083 1/20 0.45
MEN1 O00255 2/20 0.44
LMNA P02545 3/20 0.43
POLB P06746 3/20 0.43
GAA P10253 2/20 0.43
MAPK1 P28482 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL862359 0.82 MEN1 (0.56) ALDH1A1CYP1A2KDM4EHSD17B10KMT2A
SCHEMBL9755328 0.80 CYP1A2 (0.65) ALDH1A1CYP1A2KDM4EHSD17B10TSHR
SCHEMBL29660577 0.80 CYP1A2 (0.65) ALDH1A1CYP1A2KDM4EHSD17B10TSHR
SCHEMBL862528 0.80 CYP1A2 (0.54) ALDH1A1CYP1A2KDM4EHSD17B10TSHR
SCHEMBL15119495 0.78 ALDH1A1 (0.62) ALDH1A1CYP1A2KDM4EHSD17B10KMT2A
SCHEMBL17942819 0.78 ALDH1A1 (0.53) ALDH1A1CYP1A2KDM4EHSD17B10ALOX15
SCHEMBL13737815 0.78 TTR (0.45) ALDH1A1CYP1A2KDM4EHSD17B10ALOX15
SCHEMBL22509810 0.78 CYP1A2 (0.52) ALDH1A1CYP1A2KDM4EHSD17B10TSHR
SCHEMBL27807914 0.78 ALDH1A1 (0.49) ALDH1A1KDM4EHSD17B10KMT2AMAPT
SCHEMBL3835940 0.78 KMT2A (0.62) ALDH1A1CYP1A2KDM4EHSD17B10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11685738-B2 Fluorinated tetrahydronaphthyridinyl nonanoic acid derivatives and uses thereof OCUTERRA THERAPEUTICS, INC. (US) 2023-06-27 US disclosed
US-20210277000-A1 FLUORINATED TETRAHYDRONAPHTHYRIDINYL NONANOIC ACID DERIVATIVES AND USES THEREOF FELIQS CORPORATION (JP) 2021-09-09 US disclosed
US-10301307-B2 Fluorinated tetrahydronaphthyridinyl nonanoic acid derivatives and uses thereof SCIFLUOR LIFE SCIENCES, INC. (US) 2019-05-28 US disclosed
EP-2880080-B1 POLYMERS, POLYMER MEMBRANES AND METHODS OF PRODUCING THE SAME AIR PROD & CHEM (US) 2018-07-04 EP disclosed
US-20180053868-A1 PHOTOELECTRIC CONVERSION DEVICE HAVING REFLECTION PLATE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-22 US disclosed
US-20180053868-A1 PHOTOELECTRIC CONVERSION DEVICE HAVING REFLECTION PLATE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-22 US disclosed
US-9717729-B2 Fluorinated integrin antagonists SCIFLUOR LIFE SCIENCES, INC. (US) 2017-08-01 US disclosed
US-20170162808-A1 PHOTOELECTRIC CONVERSION DEVICE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-08 US disclosed
US-20170162808-A1 PHOTOELECTRIC CONVERSION DEVICE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-08 US disclosed
US-20160372675-A1 MACROMOLECULAR COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-12-22 US disclosed
US-20120205641-A1 PHOTOVOLTAIC CELL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-16 US disclosed
US-8142908-B2 Polymer light-emitting material comprising a conjugated polymer and compound exhibiting light emission from the triplet excited state and polymer light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-03-27 US disclosed
US-20120008068-A1 POLYMER COMPOUND AND POLYMER LIGHT-EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-01-12 US disclosed
US-8012603-B2 Polyanilines; strong fluorescence and large charge transporting properties SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-09-06 US disclosed
US-20080138651-A1 Polyanilines; strong fluorescence and large charge transporting properties SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-06-12 US disclosed
US-20080118773-A1 Complex Composition, Polymer Complex Compound And Polymer Light-Emitting Device SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-05-22 US disclosed
US-20080003422-A1 Polymer Compound, Polymer Thin Film and Polymer Thin Film Device Using the Same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-01-03 US disclosed
US-20070103059-A1 Composition and polymer light-emitting device SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-05-10 US disclosed
US-20070051922-A1 Polymer light-emitting material and polymer light-emitting device SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-03-08 US disclosed
US-20070040164-A1 Polymer complex compound and polymer light emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-02-22 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 (5 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-10301307-B2 Fluorinated tetrahydronaphthyridinyl nonanoic acid derivatives and uses thereof FFAR3, FFAR2, FFAR1 ALDH1A1 1949/4885CYP1A2 2338/4885KDM4E 4044/4885
US-11685738-B2 Fluorinated tetrahydronaphthyridinyl nonanoic acid derivatives and uses thereof FFAR3, FFAR2, FFAR1 ALDH1A1 1949/4885CYP1A2 2338/4885KDM4E 4044/4885
US-20080138651-A1 Polyanilines; strong fluorescence and large charge transporting properties BRS3, SLC43A1, MRPS23 ALDH1A1 4281/4885CYP1A2 3318/4885KDM4E 3786/4885
US-20210277000-A1 FLUORINATED TETRAHYDRONAPHTHYRIDINYL NONANOIC ACID DERIVATIVES AND USES THEREOF FFAR3, FFAR2, FFAR1 ALDH1A1 1949/4885CYP1A2 2338/4885KDM4E 4044/4885
US-20160372675-A1 MACROMOLECULAR COMPOUND EXOSC4, TRPC6, MRPS22 ALDH1A1 3653/4885CYP1A2 4239/4885KDM4E 2826/4885

“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.