SCHEMBL354296

SCHEMBL354296

C#C[C@]1(OC(=O)CCCCCC)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 7/20 0.74
▸ ABCB11 O95342 5/20 0.74
▸ PGR P06401 5/20 0.74
▸ CYP2C19 P33261 4/20 0.74
▸ AR P10275 4/20 0.74
▸ MAPT P10636 3/20 0.74
▸ NR3C1 P04150 3/20 0.74
▸ MEN1 O00255 3/20 0.74
▸ KMT2A Q03164 3/20 0.74
▸ ADORA3 P0DMS8 2/20 0.74
▸ CHRM1 P11229 2/20 0.74
▸ SLC6A2 P23975 2/20 0.74
▸ ADRA1A P35348 2/20 0.74
▸ MAPK1 P28482 2/20 0.74
▸ CHRM2 P08172 1/20 0.74
▸ TBXA2R P21731 1/20 0.74
▸ LMNA P02545 6/20 0.62
▸ ESR1 P03372 3/20 0.59
▸ SLC6A4 P31645 3/20 0.59
▸ SHBG P04278 2/20 0.59

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
SCHEMBL31432443 1.00 CYP3A4 (0.74) CYP3A4ABCB11PGRCYP2C19AR
SCHEMBL11696763 1.00 CYP3A4 (0.74) CYP3A4ABCB11PGRCYP2C19AR
SCHEMBL372672 1.00 CYP3A4 (0.74) CYP3A4ABCB11PGRCYP2C19AR
SCHEMBL8853780 1.00 CYP3A4 (0.74) CYP3A4ABCB11PGRCYP2C19AR
SCHEMBL11694460 1.00 CYP3A4 (0.74) CYP3A4ABCB11PGRCYP2C19AR
Norethindrone Acetate SCHEMBL8816427 0.97 CYP3A4 (0.81) CYP3A4ABCB11PGRCYP2C19AR
SCHEMBL8853802 0.93 CYP3A4 (0.79) CYP3A4ABCB11PGRCYP2C19AR
SCHEMBL8853605 0.89 CYP3A4 (0.82) CYP3A4ABCB11PGRCYP2C19AR
SCHEMBL11694464 0.89 PGR (0.62) CYP3A4ABCB11PGRCYP2C19AR
SCHEMBL11694468 0.89 PGR (0.62) CYP3A4ABCB11PGRCYP2C19AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3852608-A1 COMPOSITIONS AND METHODS FOR GLAUCOMA Aufbau Medical Innovations Limited (IE) 2021-07-28 — — EP claimed
WO-2020061550-A1 COMPOSITIONS AND METHODS FOR GLAUCOMA AUFBAU MEDICAL INNOVATIONS LIMITED (IE) 2020-03-26 — — WO claimed
US-20180071390-A1 COMPOSITIONS OF PHARMACEUTICAL ACTIVES CONTAINING DIETHYLENE GLYCOL MONOETHYL ETHER OR OTHER ALKYL DERIVATIVES THEMIS MEDICARE LIMITED (IN) 2018-03-15 — — US claimed
US-9827315-B2 Compositions of pharmaceutical actives containing diethylene glycol monoethyl ether or other alkyl derivatives THEMIS MEDICARE LIMITED (IN) 2017-11-28 — — US claimed
CN-105277633-B A kind of defects inspecting analysis method of norethindrone derivative and its intermediate 浙江仙琚制药股份有限公司 2017-06-23 — — CN claimed
US-20160089381-A1 STABILITY OF PROGESTOGEN FORMULATIONS NOVO NORDISK HEALTHCARE AG (CH) 2016-03-31 — — US claimed
CN-105392469-A Compositions of pharmaceutical actives containing diethylene glycol monoethyl ether or other alkyl derivatives THEMIS MEDICARE LTD 2016-03-09 — — CN claimed
CN-105277633-A Impurity detection analysis method of norethisterone derivatives and intermediates thereof ZHEJIANG XIANJU PHARMACEUTICAL CO LTD 2016-01-27 — — CN claimed
US-20160008376-A1 Compositions, Methods and Uses for Treating Gender-Biased Immune Disorders BIOCOPEA LIMITED (GB) 2016-01-14 — — US claimed
WO-2016005599-A1 COMPOSITIONS, METHODS AND USES FOR TREATING GENDER-BIASED IMMUNE DISORDERS BIOCOPEA LIMITED (GB) 2016-01-14 — — WO claimed
US-RE36247-E Method of hormonal treatment for menopausal or post-menopausal disorders involving continuous administration of progestogens and estrogens WOCO INVESTMENTS, LTD. (CA) 1999-07-06 — — US claimed
US-5820878-A PERSISTENTLY RELEASES ESTROGEN AND LUTEAL HORMONE; COMPRISINGELASTOMERS, BLOCK POLYMERS, CROTAMITON AND SOFTENING AGENTS HISAMITSU PHARMACEUTICAL CO., INC. (JP) 1998-10-13 — — US claimed
CN-1178465-A Once-a-month-injectable useful as depot contraceptive and in hormone replacement therapy for perimenopausal and premeno pausal women SCHERING AG (DE) 1998-04-08 — — CN claimed
WO-1998010293-A1 METHOD OF SCREENING FOR SIDE EFFECTS OF ANTICONCEPTIVES OR ESTROGEN AND/OR PROGESTERONE REPLACEMENTS OR SUPPLEMENTS NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) 1998-03-12 — — WO claimed
WO-1998003180-A2 USE OF SEX STEROIDS FUNCTION MODULATORS TO TREAT WOUNDS AND FIBROTIC DISORDERS THE VICTORIA UNIVERSITY OF MANCHESTER (GB) 1998-01-29 — — WO claimed
CN-1164187-A Transdermal patch HISAMITSU PHARMACEUTICAL CO (JP) 1997-11-05 — — CN claimed
EP-0787488-A1 PERCUTANEOUSLY ABSORBABLE PATCH Hisamitsu Pharmaceutical Co., Inc. (JP) 1997-08-06 — — EP claimed
EP-0136011-B1 A method of hormonal treatment of peri-menopausal, menopausal and post-menopausal disorders and multi-preparation pack therefor PRE JAY HOLDINGS LTD (CA) 1997-01-22 — — EP claimed
US-4826831-A Method of hormonal treatment for menopausal or post-menopausal disorders involving continuous administration of progestogens and estrogens PRE JAY HOLDINGS LIMITED (CA) 1989-05-02 — — US claimed
US-4181721-A Depot preparations in an oily, unsaturated solution for intramuscular injection SCHERING AKTIENGESELLSCHAFT (DE) 1980-01-01 — — US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20180071390-A1 COMPOSITIONS OF PHARMACEUTICAL ACTIVES CONTAINING DIETHYLENE GLYCOL MONOETHYL ETHER OR OTHER ALKYL DERIVATIVES DSG1, DEGS1, PLA2G2E CYP3A4 385/4885ABCB11 1106/4885PGR 1415/4885

“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.

Send feedback