SCHEMBL330354

SCHEMBL330354

CNc1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.55
KIF11 P52732 1/20 0.52
RAPGEF4 Q8WZA2 2/20 0.50
XPO1 O14980 2/20 0.47
IDH2 P48735 1/20 0.44
GPR35 Q9HC97 1/20 0.42
IDO1 P14902 2/20 0.41
P2RX1 P51575 5/20 0.41
LMNA P02545 1/20 0.41
CES2 O00748 1/20 0.41
ACP1 P24666 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TMPRSS4 Q9NRS4 1/20 0.39
P2RX4 Q99571 1/20 0.38
P2RX7 Q99572 1/20 0.38

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
Hydrochloric Acid SCHEMBL1968509 0.97 MAPT (0.53) MAPTKIF11RAPGEF4XPO1IDH2
SCHEMBL25811174 0.91 MAPT (0.48) MAPTKIF11RAPGEF4XPO1IDH2
SCHEMBL13181873 0.88 RAPGEF4 (0.55) MAPTKIF11RAPGEF4XPO1IDH2
SCHEMBL7944387 0.86 KIF11 (0.45) MAPTKIF11RAPGEF4XPO1IDH2
SCHEMBL13450015 0.84 KIF11 (0.44) MAPTKIF11RAPGEF4XPO1IDH2
SCHEMBL22421803 0.84 KIF11 (0.44) MAPTKIF11RAPGEF4XPO1IDH2
SCHEMBL12706897 0.84 RAPGEF4 (0.57) MAPTKIF11RAPGEF4XPO1IDH2
SCHEMBL13169800 0.84 ACP1 (0.47) MAPTKIF11RAPGEF4XPO1IDH2
SCHEMBL13223483 0.84 MAPT (0.47) MAPTKIF11RAPGEF4XPO1IDH2
SCHEMBL20040714 0.84 KIF11 (0.44) MAPTKIF11RAPGEF4XPO1IDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260042743-A1 SUBSTITUTED BENZIMIDAZOLES FOR TREATING VIRAL DISEASES COUNCIL SCIENT IND RES (IN) 2026-02-12 US disclosed
EP-4565566-A1 SUBSTITUTED BENZIMIDAZOLES FOR TREATING VIRAL DISEASES Council of Scientific and Industrial Research, an Indian Registered Body Incorporated under Regn. of Soc. Act (Act XXI of 1860) (IN) 2025-06-11 EP disclosed
US-20240239749-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS AND METHODS ESCIENT PHARMACEUTICALS INC (US) 2024-07-18 US disclosed
WO-2024028893-A1 SUBSTITUTED BENZIMIDAZOLES FOR TREATING VIRAL DISEASES COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH AN INDIAN REGISTERED BODY INCORPORATED UNDER THE REGN. OF SOC. ACT (ACT XXI OF 1860) (IN) 2024-02-08 WO disclosed
EP-4182303-B1 THERMODYNAMICALLY STABLE FORM OF SCO-101 SCANDION ONCOLOGY AS (DK) 2023-11-29 EP disclosed
US-RE49686-E1 Nitrogen-containing heterocyclic compound and use of same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-10-10 US disclosed
US-RE49686-E1 Nitrogen-containing heterocyclic compound and use of same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-10-10 US disclosed
CN-114941145-B Synthesis method of aziridine derivatives 天津理工大学 2023-08-18 CN disclosed
CN-114805093-B Preparation method of diarylamines 暨南大学 2023-04-25 CN disclosed
EP-4106030-A1 SHEET RESISTANCE COMPONENT Novaled GmbH (DE) 2022-12-21 EP disclosed
US-20070185059-A1 Antiallergic agents INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2007-08-09 US disclosed
US-20070185110-A1 Antiallergic agents INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2007-08-09 US disclosed
EP-1678185-A1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-07-12 EP disclosed
US-20060122243-A1 Antiallergic INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2006-06-08 US disclosed
US-20060100257-A1 Inhibitors against the activation of ap-1 and nfat INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2006-05-11 US disclosed
WO-2005042542-A1 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 WO disclosed
WO-2004058234-A2 PHARMACEUTICAL COMBINATIONS OF PHTHALAZINE VEGF INHIBITORS AND BENZAMIDE HDAC INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 2004-07-15 WO disclosed
EP-1237849-A1 ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE UNIVERSITY COLLEGE LONDON (GB) 2002-09-11 EP disclosed
WO-2001032604-A1 ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE UNIVERSITY COLLEGE LONDON (GB) 2001-05-10 WO disclosed
EP-0118093-A1 Trichloroacryloyl urea derivatives, process for their preparation and their use as fungicides in agriculture and horticulture NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1984-09-12 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 (6 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-20060122243-A1 Antiallergic EPX, NAT1, HNMT MAPT 2797/4885KIF11 4116/4885RAPGEF4 4609/4885
US-20060100257-A1 Inhibitors against the activation of ap-1 and nfat NFATC1, AP1G1, ATF1 MAPT 3490/4885KIF11 4830/4885RAPGEF4 1091/4885
US-20240239749-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS AND METHODS MRGPRX2, MRGPRX1, MRGPRX4 MAPT 4569/4885KIF11 1494/4885RAPGEF4 449/4885
US-20070185110-A1 Antiallergic agents NAT1, EPX, AHR MAPT 2469/4885KIF11 4190/4885RAPGEF4 4541/4885
US-20070185059-A1 Antiallergic agents NAT1, EPX, AHR MAPT 2415/4885KIF11 4154/4885RAPGEF4 4479/4885
US-20260042743-A1 SUBSTITUTED BENZIMIDAZOLES FOR TREATING VIRAL DISEASES ACE2, SARS1, NR3C2 MAPT 4297/4885KIF11 2408/4885RAPGEF4 4710/4885

“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.