SCHEMBL76635

SCHEMBL76635

O=C(O)C(CBr)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.57
SRC P12931 2/20 0.50
CYP2D6 P10635 1/20 0.50
LMNA P02545 3/20 0.48
MAPK1 P28482 1/20 0.48
POLB P06746 1/20 0.47
EPHX1 P07099 1/20 0.47
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
ALDH1A1 P00352 1/20 0.42
CPN1 P15169 1/20 0.42
CPB2 Q96IY4 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL27567090 0.86 CYP2C19 (0.47) CYP2C19SRCCYP2D6LMNAMAPK1
SCHEMBL8582632 0.83 CYP2C19 (0.53) CYP2C19SRCCYP2D6LMNAMAPK1
SCHEMBL27561228 0.83 EPHX1 (0.63) CYP2C19SRCCYP2D6LMNAMAPK1
SCHEMBL4086184 0.83 CYP2C19 (0.53) CYP2C19SRCCYP2D6LMNAMAPK1
SCHEMBL2002439 0.83 CYP2C19 (0.44) CYP2C19SRCCYP2D6LMNAMAPK1
SCHEMBL4795362 0.83 ESR1 (0.47) CYP2C19SRCCYP2D6LMNAPOLB
SCHEMBL7973743 0.81 CYP2C19 (0.61) CYP2C19SRCCYP2D6LMNAMAPK1
SCHEMBL30371912 0.81 CYP2C19 (0.61) CYP2C19SRCCYP2D6LMNAMAPK1
SCHEMBL12073123 0.81 PTPN1 (0.44) CYP2C19POLBALDH1A1CPN1CPB2
SCHEMBL23782080 0.80 L3MBTL1 (0.59) CYP2C19SRCCYP2D6LMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190106590-A1 COATING COMPOSITION CONTAINING A SORBIC ACID ESTER AND A PHOTOCATALYST DOW GLOBAL TECHNOLOGIES LLC (US) 2019-04-11 US claimed
EP-3440141-A1 COATING COMPOSITION CONTAINING SORBIC ACID ESTER AND PHOTOCATALYST Dow Global Technologies, LLC (US) 2019-02-13 EP claimed
WO-2017173646-A1 COATING COMPOSITION CONTAINING SORBIC ACID ESTER AND PHOTOCATALYST DOW GLOBAL TECHNOLOGIES LLC (US) 2017-10-12 WO claimed
CN-106905135-A A kind of preparation method to bromomethyl phenylacetic acid 上海应用技术大学 2017-06-30 CN claimed
CN-1247573-C Method for preparing arylacetyl aminothiazole BRISTOL MYERS SQUIBB CO (US) 2006-03-29 CN claimed
EP-1303512-B1 PROCESS FOR PREPARING ARYLACETYLAMINOTHIAZOLES BRISTOL MYERS SQUIBB CO (US) 2005-07-20 EP claimed
JP-2004505079-A 2004-02-19 JP claimed
US-20030216440-A1 Process for preparing arylacetylaminothiazoles CHEN BANG-CHI (US) 2003-11-20 US claimed
CN-1444583-A Method for preparing arylacetyl aminothiazole BRISTOL MYERS SQUIBB CO (US) 2003-09-24 CN claimed
US-6613911-B2 Reaction of haloarylacetic acids or esters with olefins to give vinylarylacetic acids or esters, oxidation with an oxidizing reagent gives formylarylacetic acids or esters BRISTOL-MYERS SQUIBB COMPANY 2003-09-02 US claimed
EP-1303512-A1 PROCESS FOR PREPARING ARYLACETYLAMINOTHIAZOLES Bristol-Myers Squibb Company (US) 2003-04-23 EP claimed
WO-2003011917-A1 METHOD OF CURING ELASTOMERS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2003-02-13 WO claimed
US-20020072609-A1 Process for preparing arylacetylaminothiazoles CHEN BANG-CHI (US) 2002-06-13 US claimed
WO-2002010161-A1 PROCESS FOR PREPARING ARYLACETYLAMINOTHIAZOLES BRISTOL-MYERS SQUIBB COMPANY (US) 2002-02-07 WO claimed
EP-0906265-B1 CHEMICAL PROCESS SYNGENTA LTD (GB) 2001-08-29 EP claimed
US-20010004639-A1 Process for preparing arylacetylaminothiazoles BRISTOL-MYERS SQUIBB COMPANY 2001-06-21 US claimed
EP-4572795-A2 METHODS AND COMPOSITIONS FOR TREATING CANCER WITH CANCER-BINDING ADJUVANTS The University of Chicago (US) 2025-06-25 EP disclosed
CN-116368131-B Novel Smad3 protein degradation agent and application thereof 和径医药科技(上海)有限公司 2024-09-20 CN disclosed
EP-0539066-A1 Heterocyclic compounds useful as angiotensin II antagonists ZENECA LIMITED (GB) 1993-04-28 EP disclosed
EP-0452107-A1 Pyrimidinedione derivatives and antiarrythmic agents containing same MITSUI TOATSU CHEMICALS, Inc. (JP) 1991-10-16 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 (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-20030216440-A1 Process for preparing arylacetylaminothiazoles CCNI, CCNT1, CCNA1 CYP2C19 354/4885SRC 114/4885CYP2D6 332/4885
US-20020072609-A1 Process for preparing arylacetylaminothiazoles CCNT1, CCNI, CCNA1 CYP2C19 266/4885SRC 114/4885CYP2D6 148/4885
US-20010004639-A1 Process for preparing arylacetylaminothiazoles CCNI, CCNA1, CCNT1 CYP2C19 370/4885SRC 110/4885CYP2D6 369/4885

“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.