SCHEMBL780388

SCHEMBL780388

Nc1cc(C(F)(F)F)ccc1Br

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
KDM4E B2RXH2 3/20 0.50
PKM P14618 1/20 0.50
HPGD P15428 1/20 0.50
HSD17B10 Q99714 1/20 0.50
L3MBTL1 Q9Y468 4/20 0.46
MAPT P10636 3/20 0.46
MEN1 O00255 1/20 0.46
GAA P10253 1/20 0.46
GFER P55789 1/20 0.46
KMT2A Q03164 1/20 0.46
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
CFTR P13569 1/20 0.44
LMNA P02545 2/20 0.43
RAB9A P51151 1/20 0.43
NOS3 P29474 1/20 0.42
NOS2 P35228 1/20 0.42
KIF11 P52732 2/20 0.41
BACE1 P56817 1/20 0.41

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
SCHEMBL29430899 1.00 ALDH1A1 (0.50) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL8217686 0.83 ALDH1A1 (0.45) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL40549 0.82 ALDH1A1 (0.46) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL29449219 0.82 ALDH1A1 (0.46) ALDH1A1KDM4EPKMHPGDHSD17B10
Hydrochloric Acid SCHEMBL11772004 0.80 ALDH1A1 (0.44) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL29637726 0.78 PTPN5 (0.41) ALDH1A1PKMMAPTMEN1KMT2A
SCHEMBL7863398 0.78 PTPN5 (0.41) ALDH1A1PKMMAPTMEN1KMT2A
SCHEMBL29505675 0.78 ALDH1A1 (0.55) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL161784 0.78 ALDH1A1 (0.55) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL14918987 0.77 ALDH1A1 (0.57) ALDH1A1PKMHPGDHSD17B10L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005100434-A1 HALOGEN CONTAINING EPOXY COMPOSITIONS AND THEIR PREPARATION UNIVERSITY OF NORTH TEXAS (US) 2005-10-27 WO claimed
US-20050228080-A1 Halogen containing epoxy compositions and their preparation UNIVERSITY OF NORTH TEXAS (US) 2005-10-13 US claimed
US-5354495-A Homo- or copolymerizable through ethylenic unsaturation NIPPON PAINT CO., LTD. (JP) 1994-10-11 US claimed
EP-0177122-B1 ACRYLAMIDE DERIVATIVES Nippon Paint Co., Ltd. (JP) 1992-04-01 EP claimed
US-4935413-A ELASTICITY, ADHESION AND DISPERSIBILITY NIPPON PAINT CO., LTD. (JP) 1990-06-19 US claimed
US-12617802-B2 Sulfonimidamide compounds as NLRP3 modulators GENENTECH, INC. (US) 2026-05-05 US disclosed
EP-3601235-B1 BICYCLIC HETEROARYL DERIVATIVES, PREPARATION AND THERAPEUTIC USES THEREOF XWPHARMA LTD (KY) 2026-03-04 EP disclosed
EP-4153170-B1 MAXI-K POTASSIUM CHANNEL OPENERS FOR THE TREATMENT OF FRAGILE X ASSOCIATED DISORDERS SERVIER LAB (FR) 2026-01-21 EP disclosed
EP-4655287-A2 INHIBITORS OF NLRP3 MWYNGIL THERAPEUTICS, INC. (US) 2025-12-03 EP disclosed
US-12377084-B2 ERAP1 modulators Grey Wolf Therapeutics Limited (GB) 2025-08-05 US disclosed
US-20250084094-A1 SPIROCYCLIC INHIBITORS OF APOL1 AND METHODS OF USING SAME VERTEX PHARMACEUTICALS INCORPORATED 2025-03-13 US disclosed
WO-2025049746-A1 COMPOSITIONS COMPRISING WERNER SYNDROME HELICASE INHIBITORS AND METHODS OF USING THE SAME EIKON THERAPEUTICS, INC. (US) 2025-03-06 WO disclosed
US-4493800-A REACTING A TRIFLUOROMETHYLHALOGENOBENZENE WITH COPPER CYANIDE DAIKIN KOGYO CO., LTD. (JP) 1985-01-15 US disclosed
EP-0097357-A1 Process for preparing trifluoromethylbenzene derivatives Daikin Kogyo Co., Ltd. (JP) 1984-01-04 EP disclosed
US-4209464-A Novel synthesis of 3-amino-2-methylbenzotrifluoride from N-(2-X-5-trifluoromethylphenyl)-S,S-dimethylsulfimide SCHERING CORPORATION (US) 1980-06-24 US disclosed
US-4172095-A Novel synthesis of 3-amino-2-methylbenzotrifluoride and the intermediates thereof SCHERING CORPORATION (US) 1979-10-23 US disclosed
US-4062846-A CNS STIMULANTS, MUSCLE RELAXANT E. R. SQUIBB & SONS, INC. (US) 1977-12-13 US disclosed
US-4051121-A Azo pigments having two 2-halo-5-trifluoromethylphenyl diazo component radicals and a bis-(2-hydroxynaphthoyl-3-amino)-2,5-dihalobenzene coupling component radical SANDOZ LTD. (CH) 1977-09-27 US disclosed
US-RE28939-E MUSCLE RELAXANTS, ANALGESICS SMITHKLINE CORPORATION (US) 1976-08-24 US disclosed
US-3966733-A CENTRAL NERVOUS SYSTEM STIMULANTS, MUSCLE RELAXANTS E. R. SQUIBB & SONS, INC. (US) 1976-06-29 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 (3 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-12377084-B2 ERAP1 modulators ERAP1, NR1I3, HRH4 ALDH1A1 2660/4885KDM4E 737/4885PKM 4349/4885
US-12617802-B2 Sulfonimidamide compounds as NLRP3 modulators NLRP3, NLRP1, PYCARD ALDH1A1 2022/4885KDM4E 4052/4885PKM 1724/4885
US-20250084094-A1 SPIROCYCLIC INHIBITORS OF APOL1 AND METHODS OF USING SAME APOL1, PNLIP, FMNL1 ALDH1A1 2430/4885KDM4E 4825/4885PKM 2097/4885

“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.