SCHEMBL250686

SCHEMBL250686

C=CCOC(=O)c1ccc(N)c(C)c1C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.60
HSD17B10 Q99714 3/20 0.60
TSHR P16473 1/20 0.60
CYP3A4 P08684 1/20 0.56
KDM4E B2RXH2 3/20 0.44
HPGD P15428 2/20 0.44
TP53 P04637 1/20 0.44
MAPT P10636 5/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
POLB P06746 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
GAA P10253 3/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
SNCA P37840 1/20 0.38
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRB1 P18505 1/20 0.38

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
SCHEMBL7563232 0.86 ALDH1A1 (0.72) ALDH1A1HSD17B10TSHRCYP3A4KDM4E
SCHEMBL17368442 0.85 ALDH1A1 (0.55) ALDH1A1HSD17B10TSHRCYP3A4KDM4E
SCHEMBL55681 0.82 ALDH1A1 (0.61) ALDH1A1HSD17B10TSHRCYP3A4HPGD
SCHEMBL11181389 0.80 CYP3A4 (0.73) ALDH1A1HSD17B10TSHRCYP3A4KDM4E
SCHEMBL8786921 0.80 ALDH1A1 (0.63) ALDH1A1HSD17B10TSHRCYP3A4KDM4E
SCHEMBL10587756 0.79 ALDH1A1 (0.57) ALDH1A1HSD17B10TSHRCYP3A4KDM4E
SCHEMBL9789268 0.78 ALDH1A1 (0.52) ALDH1A1HSD17B10TSHRCYP3A4KDM4E
SCHEMBL3945760 0.77 ALDH1A1 (0.55) ALDH1A1HSD17B10TSHRCYP3A4KDM4E
SCHEMBL10486967 0.77 ALDH1A1 (0.55) ALDH1A1HSD17B10TSHRCYP3A4KDM4E
SCHEMBL17368427 0.77 CYP3A4 (0.50) ALDH1A1HSD17B10TSHRCYP3A4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2675453-B1 METHODS FOR CONTROLLING PAIN IN CANINES USING A TRANSDERMAL SOLUTION OF FENTANYL ELANCO US INC (US) 2018-08-08 EP claimed
US-20170128462-A1 METHODS FOR TREATING FEMALE SEXUAL DYSFUNCTION WHILE DECREASING CARDIOVASCULAR RISK ANI PHARMACEUTICALS, INC. 2017-05-11 US claimed
EP-2675453-A1 METHODS FOR CONTROLLING PAIN IN CANINES USING A TRANSDERMAL SOLUTION OF FENTANYL ELI LILLY AND CO. (US) 2013-12-25 EP claimed
EP-2675454-A1 METHODS FOR CONTROLLING PAIN IN EQUINES USING A TRANSDERMAL SOLUTION OF FENTANYL ELI LILLY AND CO. (US) 2013-12-25 EP claimed
US-20120322828-A1 METHODS FOR CONTROLLING PAIN IN EQUINES USING A TRANSDERMAL SOLUTION OF FENTANYL ELI LILLY AND COMPANY (US) 2012-12-20 US claimed
WO-2012112355-A1 METHODS FOR CONTROLLING PAIN IN EQUINES USING A TRANSDERMAL SOLUTION OF FENTANYL ELI LILLY AND COMPANY (US) 2012-08-23 WO claimed
WO-2012112348-A1 METHODS FOR CONTROLLING PAIN IN CANINES USING A TRANSDERMAL SOLUTION OF FENTANYL ELI LILLY AND COMPANY (US) 2012-08-23 WO claimed
US-20120208849-A1 METHODS FOR CONTROLLING PAIN IN CANINES USING A TRANSDERMAL SOLUTION OF FENTANYL ELI LILLY AND COMPANY (US) 2012-08-16 US claimed
US-20120022033-A1 Methods for decreasing cardiovascular risk in postmenopausal women BIOSANTE PHARMACEUTICALS, INC. (US) 2012-01-26 US claimed
US-20120004204-A1 Methods for treating sexual dysfunction while decreasing cardiovascular risk BIOSANTE PHARMACEUTICALS, INC. (US) 2012-01-05 US claimed
US-20080131494-A1 Dermal Penetration enhancers and drug delivery systems involving same ACRUX DDS PTY LTD. 2008-06-05 US claimed
EP-1769785-A1 Dermal penetration enhancers and drug delivery systems involving same Acrux DDS Pty Ltd (AU) 2007-04-04 EP claimed
EP-1674068-A1 Dermal penetration enhancers and drug delivery systems involving same Acrux DDS Pty Ltd (AU) 2006-06-28 EP claimed
US-6818226-B2 DERMAL PENETRATION ENHANCER IS A SAFE SKIN-TOLERANT ESTER SUNSCREEN. ACRUX DDS PTY. LTD. (AU) 2004-11-16 US claimed
US-20040146469-A1 Dermal penetration enhancers and drug delivery systems involving same MONASH UNIVERSITY 2004-07-29 US claimed
US-20020028235-A1 Dermal penetration enhancers and drug delivery systems involving same ACRUX DDS PTY LTD. (AU) 2002-03-07 US claimed
US-6299900-B1 NON-OCCLUSIVE, PERCUTANEOUS OR TRANSDERMAL DRUG DELIVERY SYSTEM MONASH UNIVERSITY (AU) 2001-10-09 US claimed
EP-0901368-A4 DERMAL PENETRATION ENHANCERS AND DRUG DELIVERY SYSTEMS INVOLVING SAME UNIV MONASH (AU) 2000-01-26 EP claimed
EP-0901368-A1 DERMAL PENETRATION ENHANCERS AND DRUG DELIVERY SYSTEMS INVOLVING SAME MONASH UNIVERSITY (AU) 1999-03-17 EP claimed
WO-1997029735-A1 DERMAL PENETRATION ENHANCERS AND DRUG DELIVERY SYSTEMS INVOLVING SAME MONASH UNIVERSITY (AU) 1997-08-21 WO 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 (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-20020028235-A1 Dermal penetration enhancers and drug delivery systems involving same CUTA, ABCG2, SLC16A8 ALDH1A1 621/4885HSD17B10 885/4885TSHR 3353/4885
US-20080131494-A1 Dermal Penetration enhancers and drug delivery systems involving same SLC46A1, SLC33A1, SLC19A1 ALDH1A1 356/4885HSD17B10 619/4885TSHR 4546/4885
US-20120208849-A1 METHODS FOR CONTROLLING PAIN IN CANINES USING A TRANSDERMAL SOLUTION OF FENTANYL OPRL1, OPRK1, TRPV1 ALDH1A1 1854/4885HSD17B10 3355/4885TSHR 3144/4885
US-20040146469-A1 Dermal penetration enhancers and drug delivery systems involving same SLC46A1, SLC33A1, SLC19A1 ALDH1A1 356/4885HSD17B10 619/4885TSHR 4546/4885
US-20120322828-A1 METHODS FOR CONTROLLING PAIN IN EQUINES USING A TRANSDERMAL SOLUTION OF FENTANYL OPRL1, OPRK1, S100P ALDH1A1 1121/4885HSD17B10 2437/4885TSHR 3277/4885

“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.