SCHEMBL133680

SCHEMBL133680

N#CCC(=O)c1ccc(F)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.55
RAB9A P51151 3/20 0.55
PTPN1 P18031 1/20 0.55
CES2 O00748 1/20 0.54
CES1 P23141 1/20 0.54
HTR7 P34969 1/20 0.48
PLOD2 O00469 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.46
ALDH1A1 P00352 2/20 0.46
LMNA P02545 1/20 0.46
ALPG P10696 1/20 0.46
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
HTT P42858 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
ALOX12 P18054 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL395103 0.89 GSK3B (0.48) NPC1RAB9APTPN1CES1SMN1; SMN2
SCHEMBL11544329 0.82 TTR (0.46) NPC1RAB9APTPN1ALDH1A1LMNA
SCHEMBL14918493 0.81 TSHR (0.52) CES2CES1SMN1; SMN2ALDH1A1CA1
SCHEMBL11770219 0.81 CYP19A1 (0.57) NPC1RAB9APTPN1CES2ALDH1A1
SCHEMBL7082902 0.81 NPC1 (0.57) NPC1RAB9APTPN1CES2CES1
SCHEMBL8610853 0.79 CYP19A1 (0.51) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL3659298 0.79 TPMT (0.46) CA1CA2MEN1KMT2AMAPT
SCHEMBL1989864 0.79 CES2 (0.54) CES2CES1ALDH1A1
SCHEMBL1568921 0.79 GSK3B (0.57) NPC1RAB9ACES2CES1SMN1; SMN2
SCHEMBL135383 0.79 GSK3B (0.55) NPC1RAB9ACES2CES1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119039300-A Pyrazolopyrimidines Process for the preparation of the same 上海信诺维生物医药有限公司 2024-11-29 CN claimed
CN-119039247-A Preparation method of thiazole compound 上海信诺维生物医药有限公司 2024-11-29 CN claimed
CN-115974721-B Method for synthesizing 2-carbonyl substituted nitrile compound through 2, 2-trifluoroethyl ketone 平顶山学院 2024-07-02 CN claimed
CN-115974721-A Method for synthesizing 2-carbonyl substituted nitrile compound through 2,2,2-trifluoroethyl ketone 平顶山学院 2023-04-18 CN claimed
CN-113527205-B Preparation method of blonanserin intermediate 湖南省湘中制药有限公司 2022-04-01 CN claimed
CN-110526867-B Method for efficiently preparing blonanserin intermediate 湖南省湘中制药有限公司 2021-12-03 CN claimed
CN-214514581-U Reation kettle is used in preparation of high purity 4-fluorobenzoyl acetonitrile 天津市科莱博瑞科技有限公司 2021-10-29 CN claimed
CN-113527205-A Preparation method of blonanserin intermediate 湖南省湘中制药有限公司 2021-10-22 CN claimed
CN-111233707-B Synthesis and refining method of 4-fluorobenzoylacetonitrile 南京远淑医药科技有限公司 2020-08-18 CN claimed
CN-111233707-A Synthesis and refining method of 4-fluorobenzoylacetonitrile 南京远淑医药科技有限公司 2020-06-05 CN claimed
CN-105272883-B A kind of preparation method of the fluoro benzoyl acetonitrile of high-purity 4 天津市科莱博瑞科技有限公司 2017-09-22 CN claimed
EP-0034270-A1 Combinations of agents which give enhanced anti-inflammatory activity AMERICAN CYANAMID COMPANY (US) 1981-08-26 EP claimed
US-4083993-A ARTHRITIS AMERICAN CYANAMID CO. (US) 1978-04-11 US claimed
US-20260102390-A1 4-(2-(4-((2,4-DIOXOTHIAZOLIDIN-5-YL)METHYL)PHENOXY) DERIVATIVES AS PPARgamma AGONISTS AND AUTOTAXIN INHIBITORS FOR USE IN THE TREATMENT OF FIBROSIS UNI-PHARMA KLEON TSETIS PHARMACEUTICAL LABORATORIES S.A. (GR) 2026-04-16 US disclosed
EP-4326274-B1 PLASMA KALLIKREIN INHIBITORS MERCK SHARP & DOHME LLC (US) 2026-01-14 EP disclosed
EP-4637734-A1 4-(2-(4-((2,4-DIOXOTHIAZOLIDIN-5-YL)METHYL)PHENOXY) DERIVATIVES AS PPARy AGONISTS AND AUTOTAXIN INHIBITORS FOR USE IN THE TREATMENT OF FIBROSIS Uni-Pharma Kleon Tsetis Pharmaceutical Laboratories S.A. (GR) 2025-10-29 EP disclosed
US-4173650-A ANTIARTHRITIC AGENTS AMERICAN CYANAMID COMPANY (US) 1979-11-06 US disclosed
US-4083993-A ARTHRITIS AMERICAN CYANAMID CO. (US) 1978-04-11 US disclosed
US-4083993-A ARTHRITIS AMERICAN CYANAMID CO. (US) 1978-04-11 US disclosed
US-3951978-A ANALGESIC, ANTIARRHYTHMIC, CENTRAL NERVOUS DEPRESSANT ISTITUTO LUSO FARMACO D'ITALIA S.R.L. (IT) 1976-04-20 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 (1 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-20260102390-A1 4-(2-(4-((2,4-DIOXOTHIAZOLIDIN-5-YL)METHYL)PHENOXY) DERIVATIVES AS PPARgamma AGONISTS AND AUTOTAXIN INHIBITORS FOR USE IN THE TREATMENT OF FIBROSIS PPARG, FABP1, PPARA NPC1 1668/4885RAB9A 3277/4885PTPN1 867/4885

“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.