SCHEMBL40389

SCHEMBL40389

Oc1cccc(C(F)(F)F)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.54
MAPK1 P28482 1/20 0.54
CES2 O00748 1/20 0.54
MGLL Q99685 1/20 0.54
ALDH1A1 P00352 3/20 0.52
LMNA P02545 2/20 0.52
CA2 P00918 2/20 0.52
CA12 O43570 1/20 0.52
CYP3A4 P08684 1/20 0.52
CA5A P35218 1/20 0.52
CA9 Q16790 1/20 0.52
HSD17B10 Q99714 1/20 0.52
CA14 Q9ULX7 1/20 0.52
CA5B Q9Y2D0 1/20 0.52
MAPT P10636 2/20 0.50
ESR1 P03372 1/20 0.50
ESR2 Q92731 1/20 0.50
GAA P10253 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
TDP1 Q9NUW8 1/20 0.50

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
SCHEMBL29438909 1.00 TSHR (0.54) TSHRMAPK1CES2MGLLALDH1A1
Hydrochloric Acid SCHEMBL30129608 0.98 TSHR (0.52) TSHRMAPK1CES2MGLLALDH1A1
SCHEMBL29661200 0.98 CES2 (0.57) TSHRMAPK1CES2MGLLALDH1A1
Water SCHEMBL27470131 0.98 TSHR (0.52) TSHRMAPK1CES2MGLLALDH1A1
SCHEMBL8724379 0.98 TSHR (0.52) TSHRMAPK1CES2MGLLALDH1A1
SCHEMBL27511811 0.98 TSHR (0.52) TSHRMAPK1CES2MGLLALDH1A1
Hydrochloric Acid SCHEMBL30994527 0.98 TSHR (0.52) TSHRMAPK1CES2MGLLALDH1A1
SCHEMBL28779162 0.98 TSHR (0.52) TSHRMAPK1CES2MGLLALDH1A1
Formaldehyde SCHEMBL7528010 0.93 CES2 (0.53) TSHRMAPK1CES2MGLLALDH1A1
Cyclohexane SCHEMBL27525765 0.93 LMNA (0.49) TSHRMAPK1CES2MGLLALDH1A1

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

Appears in 5153 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12612573-B1 Hydroxyl functional fluorinated monomers as combustion aids for solid fuel ramjet fuels USA AS REPRESENTED BY DEPARTMENT OF THE ARMY 2026-04-28 US claimed
EP-4642784-A1 HETEROCYCLIC AND HETEROARYL COMPOUNDS AS INHIBITORS OF NLRP3 PTC Therapeutics, Inc. (US) 2025-11-05 EP claimed
EP-4642763-A1 CRYSTALLINE FORMS OF NLRP3 INFLAMMASOME INHIBITORS, CHEMICAL PROCESSES AND CHEMICAL COMPOUNDS Astrazeneca AB (SE) 2025-11-05 EP claimed
US-20250276958-A1 COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2025-09-04 US claimed
US-20250223290-A1 AZAINDAZOLE DERIVATIVES USEFUL AS INHIBITORS OF NOD-LIKE RECEPTOR PROTEIN 3 MERCK SHARP & DOHME LLC (US) 2025-07-10 US claimed
WO-2025128777-A1 INDAZOLE DERIVATIVES USEFUL AS INHIBITORS OF NOD-LIKE RECEPTOR PROTEIN 3 MERCK SHARP & DOHME LLC (US) 2025-06-19 WO claimed
WO-2025128781-A1 AZAINDAZOLE DERIVATIVES USEFUL AS INHIBITORS OF NOD-LIKE RECEPTOR PROTEIN 3 MERCK SHARP & DOHME LLC (US) 2025-06-19 WO claimed
CN-119732956-A NLRP3 inflammatory corpuscle inhibitor 诺华股份有限公司 2025-04-01 CN claimed
CN-113784957-B NLRP3 inflammatory corpuscle inhibitor 诺华股份有限公司 2025-02-28 CN claimed
EP-4499638-A1 PYRIDO-[3,4-D]PYRIDAZINE AMINE DERIVATIVES USEFUL AS NLRP3 DERIVATIVES Ventus Therapeutics U.S., Inc. (US) 2025-02-05 EP claimed
US-4827000-A REACTION OF FLUOROPHTHALIC ANHYDRIDE WITH A PHENOL OCCIDENTAL CHEMICAL CORPORATION (US) 1989-05-02 US claimed
EP-0308863-A2 Process for the preparation of phenoxy phthalic anhydrides OCCIDENTAL CHEMICAL CORPORATION (US) 1989-03-29 EP claimed
US-4723986-A Herbicidal oxazolidines and methods of use STAUFFER CHEMICAL COMPANY (US) 1988-02-09 US claimed
US-4585569-A FLUOROALKYLAMINE AS WORKING FLUID IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-04-29 US claimed
EP-0155423-A2 Heat pumps IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-09-25 EP claimed
EP-0150036-A1 Azolyl-aryl-alkanole-derivatives, processes for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1985-07-31 EP claimed
US-4415746-A BRONCHODILATORS; HYPOTENSIVE AND ANTIFERTILITY AGENTS; OXYTOCICS AMERICAN CYANAMID COMPANY (US) 1983-11-15 US claimed
US-4241221-A HYPOTENSIVE, ANTIULCER AMERICAN CYANAMID COMPANY (US) 1980-12-23 US claimed
US-4195983-A HERBICIDES MONSANTO COMPANY (US) 1980-04-01 US claimed
US-4085125-A 9-Thia-, 9-oxothia-, and 9-dioxothia-11,12-seco-prostaglandins and processes MERCK & CO., INC. (US) 1978-04-18 US claimed