SCHEMBL954859

SCHEMBL954859

OCc1c(C(F)(F)F)cccc1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.43
GABRA1 P14867 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
IDO1 P14902 2/20 0.38
CA2 P00918 1/20 0.38
KIF11 P52732 2/20 0.37
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
PDK2 Q15119 1/20 0.36
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
AXL P30530 1/20 0.35
NFKB1 P19838 1/20 0.35
P2RX7 Q99572 1/20 0.34
CES1 P23141 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL2776951 0.87 STIM1 (0.42) TAAR1KIF11GAAP2RX7
SCHEMBL15550999 0.87 TAAR1 (0.39) TAAR1GABRA1GABRG2GABRB3IDO1
SCHEMBL12475235 0.85 SMN1; SMN2 (0.39) TAAR1GABRA1GABRG2GABRB3IDO1
SCHEMBL30723720 0.85 RORC (0.40) TAAR1GABRA1GABRG2GABRB3GAA
SCHEMBL1372734 0.85 TAAR1 (0.38) TAAR1IDO1KIF11ALDH1A1POLB
SCHEMBL31692960 0.85 SMN1; SMN2 (0.39) TAAR1GABRA1GABRG2GABRB3IDO1
SCHEMBL12812210 0.85 TAAR1 (0.41) TAAR1GAAL3MBTL1P2RX7SMN1; SMN2
SCHEMBL20108980 0.82 MAOB (0.43) TAAR1IDO1ALDH1A1POLBTDP1
SCHEMBL6629490 0.81 TAAR1 (0.41) TAAR1IDO1CA2KIF11LMNA
SCHEMBL2879801 0.81 PDK2 (0.42) PDK2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8952083-B2 Fluorocopolymer composition and its production process ASAHI GLASS COMPANY, LIMITED (JP) 2015-02-10 US claimed
US-6620823-B2 Antiinflammatory agents; rheumatic disorders BRISTOL-MYERS SQUIBB PHARME COMPANY 2003-09-16 US claimed
US-5574194-A PESTICIDE INTERMEDIATE ROUSSEL UCLAF (FR) 1996-11-12 US claimed
EP-0557192-B1 Pyrethrinoid esters derived from 6-trifluoromethyl benzyl alcohol, process for their preparation and their use as pesticides ROUSSEL UCLAF (FR) 1996-08-21 EP claimed
EP-4484407-A2 (METH)ACRYLATE COMPOUND, ADDITIVE FOR OPTICAL RESIN, OPTICAL ELEMENT, AND OPTICAL DEVICE NIKON CORPORATION (JP) 2025-01-01 EP disclosed
CN-116082563-B (Meth) acrylate compound, optical resin additive, optical element, and optical device 株式会社 尼康 2024-09-20 CN disclosed
CN-118359760-A Optical resin, optical element, and optical device 株式会社 尼康 2024-07-19 CN disclosed
US-12006294-B2 Therapeutic compounds REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2024-06-11 US disclosed
CN-116082563-A (meth) acrylate compound, optical resin additive, optical element, and optical device 株式会社 尼康 2023-05-09 CN disclosed
US-11142636-B2 (Meth)acrylate compound, additive for optical resin, optical element, and optical device NIKON CORPORATION (JP) 2021-10-12 US disclosed
US-20190330157-A1 THERAPEUTIC COMPOUNDS REGENTS OF THE UNIVERSITY OF MINNESOTA 2019-10-31 US disclosed
US-20190330157-A1 THERAPEUTIC COMPOUNDS REGENTS OF THE UNIVERSITY OF MINNESOTA 2019-10-31 US disclosed
US-5574194-A PESTICIDE INTERMEDIATE ROUSSEL UCLAF (FR) 1996-11-12 US disclosed
US-5574194-A PESTICIDE INTERMEDIATE ROUSSEL UCLAF (FR) 1996-11-12 US disclosed
US-5504112-A INSECTICIDE, PESTICIDE ROUSSEL UCLAF (FR) 1996-04-02 US disclosed
EP-0698010-A1 N-ACYL SULFAMIC ACID ESTERS (OR THIOESTERS), N-ACYL SULFONAMIDES, AND N-SULFONYL CARBAMIC ACID ESTERS (OR THIOESTERS) AS HYPERCHOLESTEROLEMIC AGENTS WARNER-LAMBERT COMPANY (US) 1996-02-28 EP disclosed
EP-0671375-A1 Preparation of 2,6-bis(trifluoromethyl) benzyl alcohol Hoechst Schering AgrEvo S.A. (FR) 1995-09-13 EP disclosed
EP-0671375-A1 Preparation of 2,6-bis(trifluoromethyl) benzyl alcohol Hoechst Schering AgrEvo S.A. (FR) 1995-09-13 EP disclosed
US-5420159-A Pesticides, insecticides for plants and animals ROUSSEL-UCLAF (FR) 1995-05-30 US disclosed
US-5340835-A Insecticides ROUSSEL-UCLAF (FR) 1994-08-23 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 (2 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-20190330157-A1 THERAPEUTIC COMPOUNDS OPRL1, INA, OGFR TAAR1 743/4885GABRA1 601/4885GABRG2 1032/4885
US-12006294-B2 Therapeutic compounds OPRL1, INA, OGFR TAAR1 743/4885GABRA1 601/4885GABRG2 1032/4885

“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.