SCHEMBL2963066

SCHEMBL2963066

C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2C(=O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)COC(=O)CCC1CCCC1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 5/20 0.81
FNTB P49356 5/20 0.81
TSHR P16473 4/20 0.76
NR3C1 P04150 2/20 0.76
KMT2A Q03164 2/20 0.76
AR P10275 2/20 0.76
BLM P54132 2/20 0.76
MEN1 O00255 1/20 0.76
HSD17B10 Q99714 5/20 0.68
SMN1; SMN2 Q16637 4/20 0.68
SERPINA6 P08185 4/20 0.68
CYP3A4 P08684 3/20 0.68
PMP22 Q01453 3/20 0.68
LMNA P02545 3/20 0.68
SHBG P04278 2/20 0.68
CYP2D6 P10635 1/20 0.68
ALDH1A1 P00352 1/20 0.68
KCNA1 Q09470 1/20 0.68
SLC47A1 Q96FL8 1/20 0.68
HIF1A Q16665 7/20 0.58

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
SCHEMBL3403149 0.90 FNTA (0.86) FNTAFNTBTSHRNR3C1KMT2A
SCHEMBL4105697 0.88 FNTA (0.85) FNTAFNTBTSHRNR3C1KMT2A
SCHEMBL31249833 0.88 FNTA (0.82) FNTAFNTBTSHRNR3C1KMT2A
Hydrochloric Acid SCHEMBL31249712 0.87 FNTA (0.81) FNTAFNTBTSHRNR3C1KMT2A
SCHEMBL31249685 0.87 FNTA (0.81) FNTAFNTBTSHRNR3C1KMT2A
SCHEMBL11432887 0.87 FNTA (0.61) FNTAFNTBTSHRNR3C1KMT2A
Cortisone Acetate SCHEMBL9819561 0.86 FNTA (1.00) FNTAFNTBTSHRNR3C1KMT2A
Cortisone Acetate SCHEMBL4501 0.86 FNTA (1.00) FNTAFNTBTSHRNR3C1KMT2A
Cortisone Acetate SCHEMBL9819556 0.86 FNTA (1.00) FNTAFNTBTSHRNR3C1KMT2A
Cortisone Acetate SCHEMBL10301195 0.86 FNTA (1.00) FNTAFNTBTSHRNR3C1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2026818-B1 COMBINATION OF STEROIDS HAVING TRANSPORTER-ENHANCED CORTICOSTEROID ACTIVITY BODOR NICHOLAS S (US) 2010-12-22 EP claimed
US-7776846-B2 Enhancement of activity and/or duration of action of selected anti-inflammatory steroids for topical or other local application BODOR LABORATORIES, INC. 2010-08-17 US claimed
EP-2026818-A2 COMBINATION OF ANTI-INFLAMMATORY STEROIDS HAVING TRANSPORTER-ENHANCED CORTICOSTEROID ACTIVITY Bodor, Nicholas S. (US) 2009-02-25 EP claimed
US-20080261930-A1 ENHANCEMENT OF ACTIVITY AND/OR DURATION OF ACTION OF SELECTED ANTI-INFLAMMATORY STEROIDS FOR TOPICAL OR OTHER LOCAL APPLICATION BODOR LABORATORIES, INC. 2008-10-23 US claimed
US-7419971-B2 Enhancement of activity and/or duration of action of selected anti-inflammatory steroids for topical or other local application BODOR LABORATORIES, INC. 2008-09-02 US claimed
US-20080194468-A1 TRANSPORTER-ENHANCED CORTICOSTEROID ACTIVITY AND METHODS AND COMPOSITIONS FOR TREATING DRY EYE BODOR LABORATORIES, INC. 2008-08-14 US claimed
US-20080004246-A1 Transporter enhanced corticosteroid activity BODOR LABORATORIES, INC. 2008-01-03 US claimed
WO-2007142842-A2 COMBINATION OF ANTI-INFLAMMATORY STEROIDS HAVING TRANSPORTER-ENHANCED CORTICOSTEROID ACTIVITY BODOR NICHOLAS S (US) 2007-12-13 WO claimed
EP-1658083-B1 ENHANCEMENT OF ACTIVITY AND/OR DURATION OF ACTION OF SELECTED ANTI-INFLAMMATORY STEROIDS BODOR NICHOLAS S (US) 2007-08-08 EP claimed
EP-1658083-A1 ENHANCEMENT OF ACTIVITY AND/OR DURATION OF ACTION OF SELECTED ANTI-INFLAMMATORY STEROIDS BODOR, Nicholas S. (US) 2006-05-24 EP claimed
US-20050020551-A1 Enhancement of activity and/or duration of action of selected anti-inflammatory steroids for topical or other local application BODOR LABORATORIES, INC. 2005-01-27 US claimed
WO-2004112800-A1 ENHANCEMENT OF ACTIVITY AND/OR DURATION OF ACTION OF SELECTED ANTI-INFLAMMATORY STEROIDS BODOR NICHOLAS S (US) 2004-12-29 WO claimed
US-4970206-A TRANSDERMAL DRUG DELIVERY MERCK & CO., INC. (US) 1990-11-13 US claimed
EP-1996710-B1 RIFAXIMIN ANTI-RECTAL DYSFUNCTION PREPARATION SALIX PHARMACEUTICALS INC (US) 2019-08-14 EP disclosed
EP-2964196-A1 PHARMACEUTICAL COMPOSITIONS FOR RECTAL ADMINISTRATION Cipla Limited (IN) 2016-01-13 EP disclosed
US-20160002278-A1 Pharmaceutical Compositions for Rectal Administration CIPLA LIMITED (MH) 2016-01-07 US disclosed
US-4970206-A TRANSDERMAL DRUG DELIVERY MERCK & CO., INC. (US) 1990-11-13 US disclosed
US-4847250-A HYPOTENSIVE AGENTS MERCK & CO., INC. (US) 1989-07-11 US disclosed
US-4762851-A ANTIINFLAMMATORY AGENTS MERCK & CO., INC. (US) 1988-08-09 US disclosed
EP-0227531-A2 Pyroglutamic acid esters used as dermal penetration enhancers for drugs MERCK & CO. INC. (US) 1987-07-01 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 (5 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-20080194468-A1 TRANSPORTER-ENHANCED CORTICOSTEROID ACTIVITY AND METHODS AND COMPOSITIONS FOR TREATING DRY EYE HSD3B1, HSD3B2, HSD11B1 FNTA 2562/4885FNTB 2540/4885TSHR 538/4885
US-20160002278-A1 Pharmaceutical Compositions for Rectal Administration SI, CROCC, FABP2 FNTA 26/4885FNTB 36/4885TSHR 4689/4885
US-20080004246-A1 Transporter enhanced corticosteroid activity HSD3B1, HSD11B1, EBP FNTA 2220/4885FNTB 1187/4885TSHR 916/4885
US-20050020551-A1 Enhancement of activity and/or duration of action of selected anti-inflammatory steroids for topical or other local application NR3C1, NR3C2, HSD17B7 FNTA 3307/4885FNTB 3123/4885TSHR 1903/4885
US-20080261930-A1 ENHANCEMENT OF ACTIVITY AND/OR DURATION OF ACTION OF SELECTED ANTI-INFLAMMATORY STEROIDS FOR TOPICAL OR OTHER LOCAL APPLICATION NR3C1, NR3C2, HSD17B7 FNTA 3307/4885FNTB 3123/4885TSHR 1903/4885

“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.