SCHEMBL236764

SCHEMBL236764

Nc1ccc(OC(F)(F)F)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.46
TSHR P16473 2/20 0.46
SLC1A5 Q15758 2/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
KMO O15229 2/20 0.41
SCN9A Q15858 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.41
GRIN2B Q13224 2/20 0.39
S100A9 P06702 1/20 0.39
PGK1 P00558 1/20 0.37
ALDH1A1 P00352 1/20 0.37
THRB P10828 1/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
CASP1 P29466 1/20 0.37
RECQL P46063 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL30140163 1.00 CYP3A4 (0.46) CYP3A4TSHRSLC1A5CA1CA2
SCHEMBL11298945 0.86 CYP3A4 (0.45) CYP3A4TSHRSLC1A5CA1CA2
SCHEMBL22815715 0.85 KMO (0.47) CYP3A4TSHRSLC1A5KMOGRIN2B
SCHEMBL1555931 0.84 CYP3A4 (0.46) CYP3A4TSHRSLC1A5CA1CA2
SCHEMBL9447561 0.83 MEN1 (0.44) CYP3A4TSHRSLC1A5CA1CA2
SCHEMBL27483990 0.83 CYP3A4 (0.42) CYP3A4TSHRSLC1A5CA1CA2
SCHEMBL3802892 0.82 CYP3A4 (0.48) CYP3A4TSHRCA1CA2MRGPRX4
SCHEMBL9367414 0.81 GAA (0.40) CYP3A4TSHRSCN9AALDH1A1ALOX15
SCHEMBL28351619 0.80 MEN1 (0.42) CYP3A4TSHRSLC1A5CA1CA2
SCHEMBL11307249 0.80 CYP3A4 (0.39) CYP3A4TSHRSLC1A5CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12338226-B2 Substituted benzodiazoles and use thereof in therapy THOMAS HELLEDAYS STIFTELSE FOR MEDICINSK FORSKNING (SE) 2025-06-24 US disclosed
CN-116768824-B Imide azole heterocyclic compound and application thereof 华南农业大学 2025-06-10 CN disclosed
WO-2025054339-A1 TRIAZOLOPYRIDINE COMPOUNDS AS INHIBITORS OF KIT ARCUS BIOSCIENCES, INC. (US) 2025-03-13 WO disclosed
CN-119241440-A Indazole benzoic acid derivative containing urea structure and preparation method and application thereof 沈阳药科大学 2025-01-03 CN disclosed
CN-116023321-B STING inhibitor prodrug and medical application thereof 中国药科大学 2024-11-29 CN disclosed
US-20240376117-A1 IMIDAZOLE-CONTAINING INHIBITORS OF ALK2 KINASE WILMINGTON TRUST, NATIONAL ASSOCIATION 2024-11-14 US disclosed
WO-2024141128-A4 STING INHIBITOR PRODRUG AND MEDICAL USE THEREOF 中国药科大学 2024-09-19 WO disclosed
US-20240287020-A1 SUBSTITUTED BENZODIAZOLES AND USE THEREOF IN THERAPY THOMAS HELLEDAYS STIFTELSE FÖR MEDICINSK FORSKNING (SE) 2024-08-29 US disclosed
US-12054492-B2 Imidazole-containing inhibitors of ALK2 kinase BIOCRYST PHARMACEUTICALS, INC. (US) 2024-08-06 US disclosed
WO-2024151666-A1 CARBOXYLIC ACID ANALOGS AS GPX4 INHIBITORS AND USE THEREOF SONATA THERAPEUTICS, INC. (US) 2024-07-18 WO disclosed
US-4293566-A FUNGICIDES, BACTERICIDES, INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1981-10-06 US disclosed
EP-0003099-B1 N-PHENYL-N'(2-CHLORO-6-FLUORO-BENZOYL) UREA, PREPARATION THEREOF AND USE THEREOF AS INSECTICIDES BAYER AG (DE) 1981-09-16 EP disclosed
US-4277499-A Combating insects with N-(substituted-phenyl)-N-(2-chloro-6-fluoro-benzoyl)-ureas BAYER AKTIENGESELLSCHAFT (DE) 1981-07-07 US disclosed
US-4276310-A ARTHROPODICIDES, FUNGICIDES, BACTERICIDES BAYER AKTIENGESELLSCHAFT (DE) 1981-06-30 US disclosed
EP-0000156-B1 2-ARYLAMINO-3,5-DINITRO-BENZOTRIFLUORIDES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS PESTICIDES. BAYER AG (DE) 1980-11-12 EP disclosed
US-4233055-A Quaternary ammonioalkanecarboxylic acid anilides as plant growth influencing agents CIBA-GEIGY CORPORATION (US) 1980-11-11 US disclosed
US-4183949-A Pesticidally active 1-arylamino-2,4-dinitronaphthalenes BAYER AKTIENGESELLSCHAFT (DE) 1980-01-15 US disclosed
US-4141718-A ANTIGROWTH AGENTS FOR PLANTS CIBA-GEIGY CORPORATION (US) 1979-02-27 US disclosed
US-4139636-A N-Phenyl-N'-benzoyl-ureas and pesticidal compositions and uses therefor BAYER AKTIENGESELLSCHAFT (DE) 1979-02-13 US disclosed
EP-0000156-A1 2-Arylamino-3,5-dinitro-benzotrifluorides, process for their preparation and their use as pesticides. BAYER AG (DE) 1979-01-10 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 (4 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-20240376117-A1 IMIDAZOLE-CONTAINING INHIBITORS OF ALK2 KINASE ALK, ACVR2B, ACVR2A CYP3A4 3136/4885TSHR 3668/4885SLC1A5 1358/4885
US-12054492-B2 Imidazole-containing inhibitors of ALK2 kinase ALK, ACVR2B, ACVR2A CYP3A4 3136/4885TSHR 3668/4885SLC1A5 1358/4885
US-20240287020-A1 SUBSTITUTED BENZODIAZOLES AND USE THEREOF IN THERAPY XDH, CYP11B2, CYP4X1 CYP3A4 10/4885TSHR 1665/4885SLC1A5 464/4885
US-12338226-B2 Substituted benzodiazoles and use thereof in therapy XDH, CYP11B2, CYP4X1 CYP3A4 10/4885TSHR 1665/4885SLC1A5 464/4885

“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.