SCHEMBL32016

SCHEMBL32016

C=C(C)c1cccc(C(F)(F)F)c1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.60
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
NPSR1 Q6W5P4 1/20 0.51
GAA P10253 2/20 0.50
SRD5A2 P31213 1/20 0.50
ALDH1A1 P00352 2/20 0.49
POLB P06746 1/20 0.49
P2RX1 P51575 1/20 0.47
LMNA P02545 1/20 0.47

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
SCHEMBL30106109 1.00 CES2 (0.60) CES2MEN1KMT2ANPSR1GAA
SCHEMBL20219995 0.86 L3MBTL1 (0.48) CES2ALDH1A1LMNA
SCHEMBL7447900 0.83 CES2 (0.64) CES2MEN1KMT2ANPSR1GAA
SCHEMBL8865659 0.83 CES2 (0.64) CES2MEN1KMT2ANPSR1SRD5A2
SCHEMBL15582371 0.83 HTT (0.45) CES2ALDH1A1POLBLMNA
SCHEMBL1304921 0.82 L3MBTL1 (0.48) ALDH1A1POLBLMNA
SCHEMBL24249964 0.82 L3MBTL1 (0.42) CES2MEN1KMT2ANPSR1ALDH1A1
SCHEMBL19710741 0.82 CES2 (0.62) CES2MEN1KMT2ANPSR1GAA
SCHEMBL23590445 0.82 NPSR1 (0.43) CES2MEN1KMT2ANPSR1ALDH1A1
SCHEMBL16426168 0.82 L3MBTL1 (0.45) ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250115576-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2025-04-10 US disclosed
US-12209075-B2 Pyridine-sulfonamide derivatives as sodium channel inhibitors GENENTECH, INC. (US) 2025-01-28 US disclosed
CN-117903071-A Synthesis method of alpha-aminoketone derivative 湖州师范学院 2024-04-19 CN disclosed
US-20230324797-A1 POSITIVE RESIST COMPOSITION FOR EXTREME ULTRAVIOLET LITHOGRAPHY AND RESIST PATTERN FORMATION KIT FOR EXTREME ULTRAVIOLET LITHOGRAPHY ZEON CORPORATION (JP) 2023-10-12 US disclosed
US-20230324797-A1 POSITIVE RESIST COMPOSITION FOR EXTREME ULTRAVIOLET LITHOGRAPHY AND RESIST PATTERN FORMATION KIT FOR EXTREME ULTRAVIOLET LITHOGRAPHY ZEON CORPORATION (JP) 2023-10-12 US disclosed
WO-2023189969-A1 RESIST COMPOSITION AND METHOD FOR FORMING RESIST PATTERN 日本ゼオン株式会社 2023-10-05 WO disclosed
US-20230288805-A1 COPOLYMER, POSITIVE RESIST COMPOSITION, AND METHOD OF FORMING RESIST PATTERN ZEON CORPORATION (JP) 2023-09-14 US disclosed
US-20230288805-A1 COPOLYMER, POSITIVE RESIST COMPOSITION, AND METHOD OF FORMING RESIST PATTERN ZEON CORPORATION (JP) 2023-09-14 US disclosed
US-11644752-B2 Polymer, positive resist composition, and method of forming resist pattern ZEON CORPORATION (JP) 2023-05-09 US disclosed
US-11644752-B2 Polymer, positive resist composition, and method of forming resist pattern ZEON CORPORATION (JP) 2023-05-09 US disclosed
CN-101781161-A Method for preparing trifluoromethyl styrene compound SHANGHAI CHEMEXPLORER CO LTD 2010-07-21 CN disclosed
EP-0350069-B1 METHOD FOR OXIDIZING UNSATURATED AROMATIC COMPOUNDS NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1993-03-17 EP disclosed
US-5006151-A Herbicides THE DOW CHEMICAL COMPANY (US) 1991-04-09 US disclosed
US-4967009-A REACTING UNSATURATED AROMATIC COMPOUNDS WITH AROMATIC IODOSYL COMPOUNDS TO YIELD AROMATIC ALDEHYDES OR KETONES NIPPON PETROCHEMICALS CO., LTD. (JP) 1990-10-30 US disclosed
US-4929268-A HERBICIDES THE DOW CHEMICAL COMPANY (US) 1990-05-29 US disclosed
EP-0350069-A2 Method for oxidizing unsaturated aromatic compounds NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1990-01-10 EP disclosed
US-4851594-A HERBICIDES, POLYHALO SUBSTITUTED STYRENE INTERMEDIATES THE DOW CHEMICAL COMPANY (US) 1989-07-25 US disclosed
US-4629492-A HERBICIDES THE DOW CHEMICAL COMPANY (US) 1986-12-16 US disclosed
US-4085165-A ISOCYANATE PREPOLYMER, VINYL COMPOUND, POLYAMINE OR POLYETHER CURING AGENT BRIDGESTONE TIRE CO., LTD. (JA) 1978-04-18 US disclosed
US-3932573-A Process for producing glass fiber reinforced injection molding compounds ETHYL CORPORATION (US) 1976-01-13 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 (2 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-12209075-B2 Pyridine-sulfonamide derivatives as sodium channel inhibitors SCN1B, CACNA1A, SCN1A CES2 2259/4885MEN1 2471/4885KMT2A 1865/4885
US-20250115576-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF F12, REN, ZYX CES2 644/4885MEN1 81/4885KMT2A 3021/4885

“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.