SCHEMBL204960

SCHEMBL204960

CC(C)C(=O)c1ccc(F)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.54
CES1 P23141 1/20 0.54
KDM4E B2RXH2 1/20 0.52
DBH P09172 1/20 0.52
GAA P10253 1/20 0.52
RECQL P46063 1/20 0.52
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
BCL2L1 Q07817 1/20 0.46
BAD Q92934 1/20 0.46
NPC1 O15118 2/20 0.46
ALDH1A1 P00352 2/20 0.46
HPGD P15428 1/20 0.46
PTPN1 P18031 1/20 0.45
RAB9A P51151 1/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
HTR7 P34969 1/20 0.44
MAPT P10636 1/20 0.44
LTA4H P09960 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
SCHEMBL6726501 1.00 CES2 (0.54) CES2CES1KDM4EDBHGAA
SCHEMBL19130713 0.88 HPGD (0.48) CES2CES1KDM4EDBHGAA
SCHEMBL10121174 0.87 KDM4E (0.62) CES2CES1KDM4EDBHGAA
SCHEMBL4869727 0.84 CES2 (0.52) CES2CES1CA1CA2BCL2L1
SCHEMBL2448326 0.84 CES2 (0.52) CES2CES1CA1CA2BCL2L1
SCHEMBL29077329 0.84 CES2 (0.52) CES2CES1CA1CA2BCL2L1
SCHEMBL526237 0.83 CES2 (0.46) CES2CES1CA1CA2BCL2L1
SCHEMBL25214258 0.82 CES2 (0.50) CES2CES1CA1CA2BCL2L1
SCHEMBL1938267 0.82 CES2 (0.50) CES2CES1CA1CA2BCL2L1
SCHEMBL3852076 0.82 CES2 (0.50) CES2CES1CA1CA2BCL2L1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4400504-A1 THIOPHENE RING COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Center for Excellence in Molecular Cell Science, Chinese Academy of Sciences (CN) 2024-07-17 EP disclosed
CN-114853586-B Preparation method of phenanthrene ketone derivative 扬州市职业大学(扬州开放大学) 2024-03-15 CN disclosed
US-11866430-B2 Naphthyridinone compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2024-01-09 US disclosed
CN-112585139-B Naphthyridinone compounds as T cell activators 百时美施贵宝公司 2023-12-01 CN disclosed
US-20230348369-A1 NAMPT MODULATORS CYTOKINETICS, INC. 2023-11-02 US disclosed
US-20230348369-A1 NAMPT MODULATORS CYTOKINETICS, INC. 2023-11-02 US disclosed
EP-3743430-B1 AMINOPYRROLOTRIAZINES AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2023-08-02 EP disclosed
WO-2023125825-A1 ANTICORONVIRAL COMPOUNDS AND COMPOSITIONS AND USES THEREOF SHANGHAI CUREGENE PHARMACEUTICAL CO., LTD. (CN) 2023-07-06 WO disclosed
US-11667606-B2 Thyromimetics AUTOBAHN THERAPEUTICS, INC. (US) 2023-06-06 US disclosed
US-11667621-B2 Antiestrogen compounds STEVENS INSTITUTE OF TECHNOLOGY (US) 2023-06-06 US disclosed
US-5977357-A Phenyl alkyl ketone substituted by cyclic amine and a process for the preparation thereof CIBA SPECIALTY CHEMICAL CORPORATION (US) 1999-11-02 US disclosed
US-5795985-A Phenyl alkyl ketone substituted by cyclic amine and a process for the preparation thereof CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-08-18 US disclosed
US-5145885-A Morpholine compound, binders CIBA-GEIGY CORPORATION (US) 1992-09-08 US disclosed
EP-0273647-B1 COUMARAN DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1992-03-11 EP disclosed
US-4992547-A Aminoaryl ketone photoinitiators CIBA-GEIGY CORPORATION (US) 1991-02-12 US disclosed
US-4857516-A Coumaran derivatives and their pharmaceutical use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1989-08-15 US disclosed
EP-0273647-A1 Coumaran derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1988-07-06 EP disclosed
US-4454350-A Process for the acylation of halo- or trihalomethylbenzenes RHONE-POULENC SPECIALITIES CHIMIQUES (FR) 1984-06-12 US disclosed
US-RE30634-E INSECTICIDES SHELL OIL COMPANY (US) 1981-06-02 US disclosed
US-4079149-A INSECTICIDES SHELL OIL COMPANY (US) 1978-03-14 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 (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-11667606-B2 Thyromimetics TPO, TSHR, TTR CES2 1424/4885CES1 194/4885KDM4E 3895/4885
US-11667621-B2 Antiestrogen compounds ESR1, ESR2, ESRRG CES2 2344/4885CES1 1306/4885KDM4E 434/4885
US-20230348369-A1 NAMPT MODULATORS NAMPT, NNT, NAPRT CES2 3202/4885CES1 1593/4885KDM4E 2846/4885
US-11866430-B2 Naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG CES2 4194/4885CES1 2321/4885KDM4E 2027/4885

“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.