SCHEMBL4676342

SCHEMBL4676342

CCCCCNC(=O)N(O)C=O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 10/20 0.50
ZDHHC20 Q5W0Z9 1/20 0.47
ZDHHC2 Q9UIJ5 1/20 0.47
CASP2 P42575 1/20 0.46
NAAA Q02083 1/20 0.43
EPHX2 P34913 2/20 0.42
ADH1B P00325 1/20 0.42
ADH1C P00326 1/20 0.42
ADH1A P07327 1/20 0.42
ADH4 P08319 1/20 0.42
ADH7 P40394 1/20 0.42
PAOX Q6QHF9 1/20 0.41
DPP7 Q9UHL4 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
SCHEMBL7684384 0.78 EPHX1 (0.52) EPHX1ZDHHC20ZDHHC2CASP2NAAA
SCHEMBL9781816 0.76 EPHX1 (0.59) EPHX1ZDHHC20ZDHHC2CASP2NAAA
SCHEMBL11868180 0.76 EPHX1 (0.59) EPHX1ZDHHC20ZDHHC2CASP2NAAA
SCHEMBL7435302 0.75 EPHX1 (0.58) EPHX1ZDHHC20ZDHHC2CASP2NAAA
SCHEMBL25272490 0.74 EPHX1 (0.61) EPHX1ZDHHC20ZDHHC2CASP2NAAA
SCHEMBL25229374 0.74 EPHX1 (0.61) EPHX1ZDHHC20ZDHHC2CASP2NAAA
SCHEMBL25271573 0.74 EPHX1 (0.61) EPHX1ZDHHC20ZDHHC2CASP2NAAA
SCHEMBL25226017 0.74 EPHX1 (0.61) EPHX1ZDHHC20ZDHHC2CASP2NAAA
SCHEMBL9623877 0.74 EPHX1 (0.61) EPHX1ZDHHC20ZDHHC2CASP2NAAA
SCHEMBL25271060 0.74 EPHX1 (0.61) EPHX1ZDHHC20ZDHHC2CASP2NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8871750-B2 Use of aromatase inhibitors for endometrial thinning in preparation for surgical procedures on the endometrial cavity and uterus WAYNE STATE UNIVERSITY (US) 2014-10-28 US disclosed
EP-1804805-A4 USE OF AROMATASE INHIBITORS FOR THE TREATMENT OF ECTOPIC PREGNANCY UNIV WAYNE STATE (US) 2008-08-13 EP disclosed
US-20080045484-A1 Use of Aromatase Inhibitors for Endometrial Thinning in Preparation for Surgical Procedures on the Endometrial Cavity and Uterus MOUNT SINAI HOSPITAL (CA) 2008-02-21 US disclosed
US-20080025991-A1 Use of Aromatase Inhibitors for Treatment of Ectopic Pregnancy MOUNT SINAI HOSPITAL (CA) 2008-01-31 US disclosed
EP-1804819-A4 USE OF AROMATASE INHIBITORS FOR ENDOMETRIAL THINNING IN PREPARATION FOR SURGICAL PROCEDURES ON THE ENDOMETRIAL CAVITY AND UTERUS UNIV WAYNE STATE (US) 2007-12-12 EP disclosed
EP-1804805-A2 USE OF AROMATASE INHIBITORS FOR THE TREATMENT OF ECTOPIC PREGNANCY WAYNE STATE UNIVERSITY (US) 2007-07-11 EP disclosed
EP-1804819-A2 USE OF AROMATASE INHIBITORS FOR ENDOMETRIAL THINNING IN PREPARATION FOR SURGICAL PROCEDURES ON THE ENDOMETRIAL CAVITY AND UTERUS WAYNE STATE UNIVERSITY (US) 2007-07-11 EP disclosed
WO-2006041939-A2 USE OF AROMATASE INHIBITORS FOR ENDOMETRIAL THINNING IN PREPARATION FOR SURGICAL PROCEDURES ON THE ENDOMETRIAL CAVITY AND UTERUS WAYNE STATE UNIVERSITY (US) 2006-04-20 WO disclosed
WO-2006041941-A2 USE OF AROMATASE INHIBITORS FOR THE TREATMENT OF ECTOPIC PREGNANCY WAYNE STATE UNIVERSITY (US) 2006-04-20 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 (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-20080045484-A1 Use of Aromatase Inhibitors for Endometrial Thinning in Preparation for Surgical Procedures on the Endometrial Cavity and Uterus CYP19A1, SHBG, HSD17B11 EPHX1 1711/4885ZDHHC20 2900/4885ZDHHC2 3332/4885
US-20080025991-A1 Use of Aromatase Inhibitors for Treatment of Ectopic Pregnancy CYP19A1, HSD17B11, CYP17A1 EPHX1 75/4885ZDHHC20 2048/4885ZDHHC2 1677/4885

“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.