SCHEMBL2617042

SCHEMBL2617042

CC(=O)C1CCCCC1C(C)=O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 4/20 0.46
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
KDM4E B2RXH2 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PSEN1 P49768 3/20 0.33
PSEN2 P49810 3/20 0.33
APH1B Q8WW43 3/20 0.33
NCSTN Q92542 3/20 0.33
APH1A Q96BI3 3/20 0.33
PSENEN Q9NZ42 3/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL19658338 1.00 EPHX1 (0.46) EPHX1CES2CES1KDM4EHTT
SCHEMBL22872257 1.00 EPHX1 (0.46) EPHX1CES2CES1KDM4EHTT
SCHEMBL18735714 1.00 EPHX1 (0.46) EPHX1CES2CES1KDM4EHTT
SCHEMBL25574876 0.93 EPHX1 (0.40) EPHX1CES2CES1KDM4EHTT
SCHEMBL13872421 0.93 EPHX1 (0.40) EPHX1CES2CES1KDM4EHTT
SCHEMBL28004056 0.91 EPHX1 (0.41) EPHX1CES2CES1KDM4EHTT
SCHEMBL18532477 0.90 EPHX1 (0.39) EPHX1KDM4EHTTSMN1; SMN2PSEN1
SCHEMBL1115372 0.89 KDM4E (0.47) KDM4EHTTSMN1; SMN2
SCHEMBL18435274 0.89 KDM4E (0.47) KDM4EHTTSMN1; SMN2
SCHEMBL16141882 0.89 KDM4E (0.47) KDM4EHTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11874434-B2 Ophthalmic devices comprising photochromic materials with reactive substituents JOHNSON & JOHNSON VISION CARE, INC. (US) 2024-01-16 US disclosed
US-11874434-B2 Ophthalmic devices comprising photochromic materials with reactive substituents JOHNSON & JOHNSON VISION CARE, INC. (US) 2024-01-16 US disclosed
WO-2022115719-A1 PD-L1 BINDING PEPTIDES AND PEPTIDE COMPLEXES AND METHODS OF USE THEREOF FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2022-06-02 WO disclosed
US-20220137262-A1 OPHTHALMIC DEVICES COMPRISING PHOTOCHROMIC MATERIALS WITH REACTIVE SUBSTITUENTS JOHNSON & JOHNSON VISION CARE (US) 2022-05-05 US disclosed
US-11256002-B2 Ophthalmic devices comprising photochromic materials with reactive substituents JOHNSON & JOHNSON VISION CARE, INC. (US) 2022-02-22 US disclosed
US-20210171811-A1 ADHESIVE METHOD USING TWO-COMPONENT ADHESIVES BASED ON COMPOUNDS HAVING CYCLOTHIOCARBONATE UNITS BASF SE (DE) 2021-06-10 US disclosed
EP-3283550-B1 CATALYST CONTAINING AMIDINE GROUPS SIKA TECH AG (CH) 2020-12-16 EP disclosed
US-20200385518-A1 FLUORINATED ETHER POLYMER, THE PREPARATION METHOD THERFORE AND USE THEREOF AKZO NOBEL COATINGS INTERNATIONAL B.V. (NL) 2020-12-10 US disclosed
EP-3294803-B1 GUANIDINE GROUP CONTAINING CATALYST SIKA TECH AG (CH) 2020-12-09 EP disclosed
US-10689317-B2 Methods of making fused ring compounds TRANSITIONS OPTICAL, INC. (US) 2020-06-23 US disclosed
US-20080160452-A1 Developer for light sensitive planographic printing plate material and manufacturing process of planographic printing plate employing the same KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2008-07-03 US disclosed
US-20080102406-A1 LIGHT SENSITIVE PLANOGRAPHIC PRINTING PLATE MATERIAL AND MANUFACTURING PROCESS OF PRINTING PLATE EMPLOYING THE SAME KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2008-05-01 US disclosed
US-20080103301-A1 PHOTOCHROMIC MATERIALS DEMONSTRATING IMPROVED FADE RATES TRANSITIONS OPTICAL, INC. (US) 2008-05-01 US disclosed
US-20080103301-A1 PHOTOCHROMIC MATERIALS DEMONSTRATING IMPROVED FADE RATES TRANSITIONS OPTICAL, INC. (US) 2008-05-01 US disclosed
WO-2007140071-A1 PHOTOCHROMIC MATERIALS COMPRISING HALOALKYL GROUPS TRANSITIONS OPTICAL, INC. (US) 2007-12-06 WO disclosed
US-20070278460-A1 Photochromic materials comprising metallocenyl groups TRANSITIONS OPTICAL LIMITED (IE) 2007-12-06 US disclosed
US-20070278460-A1 Photochromic materials comprising metallocenyl groups TRANSITIONS OPTICAL LIMITED (IE) 2007-12-06 US disclosed
US-20070278461-A1 PHOTOCHROMIC MATERIALS COMPRISING HALOALKYL GROUPS TRANSITIONS OPTICAL, INC. (US) 2007-12-06 US disclosed
US-20070278461-A1 PHOTOCHROMIC MATERIALS COMPRISING HALOALKYL GROUPS TRANSITIONS OPTICAL, INC. (US) 2007-12-06 US disclosed
US-7226971-B2 Polyester resin with carbamate functionality, a method of preparing the resin, and a coating composition utilizing the resin BASF CORPORATION (US) 2007-06-05 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-20080103301-A1 PHOTOCHROMIC MATERIALS DEMONSTRATING IMPROVED FADE RATES PNPO, FLAD1, CRY2 EPHX1 728/4885CES2 946/4885CES1 1905/4885
US-10689317-B2 Methods of making fused ring compounds CYP2B6, CYP2A6, INTS6 EPHX1 480/4885CES2 650/4885CES1 450/4885
US-20210171811-A1 ADHESIVE METHOD USING TWO-COMPONENT ADHESIVES BASED ON COMPOUNDS HAVING CYCLOTHIOCARBONATE UNITS CDH1, EPCAM, ICAM1 EPHX1 1541/4885CES2 629/4885CES1 4055/4885
US-20070278461-A1 PHOTOCHROMIC MATERIALS COMPRISING HALOALKYL GROUPS TELO2, EYA3, CRY2 EPHX1 1636/4885CES2 667/4885CES1 2165/4885

“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.