SCHEMBL8396643

SCHEMBL8396643

CCOC(=O)NC1CCC1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 5/20 0.53
THRB P10828 1/20 0.46
ATM Q13315 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
GAA P10253 1/20 0.44
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MMP1 P03956 1/20 0.44
MMP2 P08253 1/20 0.44
HSD11B1 P28845 1/20 0.43
CASP6 P55212 1/20 0.43
MAPT P10636 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
SCHEMBL1053459 0.96 EPHX1 (0.57) EPHX1THRBATML3MBTL1GAA
SCHEMBL2802318 0.94 EPHX1 (0.60) EPHX1THRBATML3MBTL1NPSR1
SCHEMBL8393517 0.94 EPHX1 (0.60) EPHX1THRBATML3MBTL1NPSR1
SCHEMBL20350198 0.94 EPHX1 (0.60) EPHX1THRBATML3MBTL1NPSR1
Hydrochloric Acid SCHEMBL4535556 0.92 EPHX1 (0.58) EPHX1THRBATML3MBTL1NPSR1
SCHEMBL7788916 0.91 SMYD3 (0.47) EPHX1THRBATML3MBTL1NFKB1
SCHEMBL7470486 0.91
SCHEMBL18380884 0.91 SMYD3 (0.47) EPHX1THRBATML3MBTL1NFKB1
Hydrochloric Acid SCHEMBL3971132 0.89 SMYD3 (0.46) EPHX1THRBATML3MBTL1NFKB1
SCHEMBL8408096 0.86 EPHX1 (0.61) EPHX1THRBATML3MBTL1NPSR1

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
US-20250066344-A1 BENZOTHIAZOLE, BENZOISOXAZOLE, AND BENZODIOXOLE ANALOGS AS RXFP1 RECEPTOR AGONISTS BRISTOL MYERS SQUIBB CO (US) 2025-02-27 US disclosed
US-20250011288-A1 RXFP1 AGONISTS BRISTOL MYERS SQUIBB CO (US) 2025-01-09 US disclosed
EP-4448508-A1 BENZOTHIOPHENE DERIVATIVES AS RXFP1 AGONISTS Bristol-Myers Squibb Company (US) 2024-10-23 EP disclosed
EP-4448504-A1 NAPHTHALENE AND QUINOLINE ANALOGS AS RXFP1 AGONISTS Bristol-Myers Squibb Company (US) 2024-10-23 EP disclosed
EP-4284854-A1 REPROCESSABLE COMPOSITIONS Massachusetts Institute of Technology (US) 2023-12-06 EP disclosed
WO-2023114823-A1 BENZOTHIOPHENE DERIVATIVES AS RXFP1 AGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-06-22 WO disclosed
WO-2023114818-A1 NAPHTHALENE AND QUINOLINE ANALOGS AS RXFP1 AGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-06-22 WO disclosed
WO-2022164503-A1 REPROCESSABLE COMPOSITIONS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2022-08-04 WO disclosed
WO-2014088519-A1 COMPOUNDS INCLUDING MAP KINASE INTERACTING KINASES 1 AND 2 (MNK1 AND MNK2) MODULATORS AND ABL AND ABL (T315I) INHIBITORS, AND USES THEREOF AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (A*STAR) (SG) 2014-06-12 WO disclosed
US-7589220-B2 Enzyme inhibitors for anandamide transporter and pharmacological use with urea, amide, thiourea or other groups UNIVERSITY OF CONNECTICUT (US) 2009-09-15 US disclosed
US-5864043-A CARDIOVASCULAR DISORDERS AND ANGIOTENSIN ANTAGONIST KARL THOMAE GMBH (DE) 1999-01-26 US disclosed
US-5541229-A ANGIOITENSIN II ANTAGONIST AS HYPOTENSIVE AGENTS, ANTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS DR. KARL THOMAE GMBH (DE) 1996-07-30 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-20250066344-A1 BENZOTHIAZOLE, BENZOISOXAZOLE, AND BENZODIOXOLE ANALOGS AS RXFP1 RECEPTOR AGONISTS RXFP1, RXFP2, RXFP3 EPHX1 1084/4885THRB 996/4885ATM 3965/4885
US-20250011288-A1 RXFP1 AGONISTS RXFP1, RXFP2, RXFP3 EPHX1 1459/4885THRB 345/4885ATM 4032/4885

“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.