SCHEMBL900308

SCHEMBL900308

C=CC(=O)NCc1ccc(C#N)c(C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.50
RXRB P28702 1/20 0.50
RXRG P48443 1/20 0.50
TGM2 P21980 1/20 0.47
AR P10275 11/20 0.46
TAS2R14 Q9NYV8 1/20 0.41
BTK Q06187 2/20 0.41
EGFR P00533 1/20 0.41

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
SCHEMBL29129593 0.81 RXRA (0.47) RXRARXRBRXRGARTAS2R14
SCHEMBL28465111 0.81 RXRA (0.49) RXRARXRBRXRGAR
SCHEMBL3544782 0.80 P2RX7 (0.52) TGM2
SCHEMBL23274113 0.78 RXRA (0.48) RXRARXRBRXRGAR
SCHEMBL21924973 0.77 TGM2 (0.54) TGM2ARTAS2R14
SCHEMBL28084056 0.75 RXRA (0.63) RXRARXRBRXRGARTAS2R14
SCHEMBL12984770 0.74 RXRA (0.79) RXRARXRBRXRGARTAS2R14
SCHEMBL20456248 0.73 TGM2 (0.63) TGM2
SCHEMBL10194672 0.73 TGM2 (0.63) TGM2
SCHEMBL28084058 0.73 RXRA (0.54) RXRARXRBRXRGAR

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119529932-A High-adhesion port machine lubricating grease and preparation method thereof 虎牌石油(中国)有限公司 2025-02-28 CN disclosed
CN-117071028-A Aluminum alloy profile surface treatment process 宁波锦华铝业有限公司 2023-11-17 CN disclosed
US-8895772-B2 Process for preparing bicalutamide SHILPA MEDICARE LIMITED (IN) 2014-11-25 US disclosed
US-20130274501-A1 PROCESS FOR PREPARING BICALUTAMIDE SHILPA MEDICARE LIMITED (IN) 2013-10-17 US disclosed
WO-2012042532-A1 PROCESS FOR PREPARING BICALUTAMIDE SHILPA MEDICARE LIMITED (IN) 2012-04-05 WO disclosed
US-20080177109-A1 Novel Process for Preparation of Bicalutamide USV LIMITED (IN) 2008-07-24 US disclosed
EP-1863759-A1 PROCESS FOR PREPARATION OF BICALUTAMIDE USV LIMITED (IN) 2007-12-12 EP disclosed
WO-2006103689-A1 PROCESS FOR PREPARATION OF BICALUTAMIDE USV LIMITED (IN) 2006-10-05 WO disclosed
EP-1322603-A1 PROCESS FOR THE PREPARATION OF N-(SUBSTITUTED PHENYL)-3-ALKYL-, ARYL- AND HETEROARYLSULFONYL-2-HYDROXY-2-ALKYL- AND HALOALKYLPROPANAMIDE COMPOUNDS Bristol-Myers Squibb Company (US) 2003-07-02 EP disclosed
US-6562994-B2 Reacting a substituted halo- or sulfonylbenzene with an alpha, beta unsaturated propanamide; followed by epoxidation, reacting with a thiol and oxidizing; no chromatographic separations; uses less expensive starting materials BRISTOL-MYERS SQUIBB CO. 2003-05-13 US disclosed
US-20020086902-A1 Process for the preparation of N-(substituted phenyl)-3-alkyl-,aryl- and heteroarylsulfonyl-2-hydroxy-2-alkyl-and haloalkylpropanamide compounds BRISTOL-MYERS SQUIBB COMPANY 2002-07-04 US disclosed
WO-2002024638-A1 PROCESS FOR THE PREPARATION OF N-(SUBSTITUTED PHENYL)-3-ALKYL-, ARYL- AND HETEROARYLSULFONYL-2-HYDROXY-2-ALKYL- AND HALOALKYLPROPANAMIDE COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2002-03-28 WO 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 (3 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-20020086902-A1 Process for the preparation of N-(substituted phenyl)-3-alkyl-,aryl- and heteroarylsulfonyl-2-hydroxy-2-alkyl-and haloalkylpropanamide compounds NR5A1, CYP17A1, CYP19A1 RXRA 1797/4885RXRB 2346/4885RXRG 2964/4885
US-20130274501-A1 PROCESS FOR PREPARING BICALUTAMIDE NR5A1, AR, SRD5A1 RXRA 4244/4885RXRB 3914/4885RXRG 4214/4885
US-20080177109-A1 Novel Process for Preparation of Bicalutamide PKD1, CYP11A1, CBR3 RXRA 4670/4885RXRB 4650/4885RXRG 4620/4885

“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.