SCHEMBL138880

SCHEMBL138880

CCCCCCCCCCCCOC(=O)C(C)N(C)C

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.52
EPHX1 P07099 1/20 0.48
TSHR P16473 3/20 0.47
SPHK1 Q9NYA1 1/20 0.46
HCAR2 Q8TDS4 1/20 0.44
RAD52 P43351 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
FAAH O00519 1/20 0.43
DNM1 Q05193 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
ACHE P22303 5/20 0.43

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
SCHEMBL15796463 1.00 NAAA (0.52) NAAAEPHX1TSHRSPHK1HCAR2
SCHEMBL27733410 1.00 NAAA (0.52) NAAAEPHX1TSHRSPHK1HCAR2
SCHEMBL462188 1.00 NAAA (0.52) NAAAEPHX1TSHRSPHK1HCAR2
SCHEMBL15305328 1.00 NAAA (0.52) NAAAEPHX1TSHRSPHK1HCAR2
SCHEMBL21184186 1.00 NAAA (0.52) NAAAEPHX1TSHRSPHK1HCAR2
SCHEMBL15796319 1.00 NAAA (0.52) NAAAEPHX1TSHRSPHK1HCAR2
SCHEMBL453610 1.00 NAAA (0.52) NAAAEPHX1TSHRSPHK1HCAR2
SCHEMBL15305326 1.00 NAAA (0.52) NAAAEPHX1TSHRSPHK1HCAR2
SCHEMBL15796587 1.00 NAAA (0.52) NAAAEPHX1TSHRSPHK1HCAR2
Hydrochloric Acid SCHEMBL15568552 0.98 NAAA (0.50) NAAAEPHX1TSHRSPHK1HCAR2

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 1150 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4338740-A1 A TRANSDERMAL PATCH FOR PROMOTING OR ACCELERATING MYELINATION AND/OR REMYELINATION Johannes Gutenberg-Universität Mainz (DE) 2024-03-20 EP claimed
US-11872319-B2 Intraoperative topically-applied non-implantable rapid release patch PRIVO TECHNOLOGIES, INC. (US) 2024-01-16 US claimed
EP-4168116-A1 TOPICAL FORMULATIONS OF (1S)-1-PHENYL-2-PYRIDIN-2-YLETHANAMINE Biohaven Therapeutics Ltd. (US) 2023-04-26 EP claimed
CN-115836052-A Topical formulations of (1S) -1-phenyl-2-pyridin-2-ylethylamine 拜尔哈文制药股份有限公司 2023-03-21 CN claimed
US-11357792-B2 Method of administration and treatment Dyvve Biosciences, Inc. (US) 2022-06-14 US claimed
CN-114404424-A A pharmaceutical composition for treating alopecia, and its preparation method 硬核医药科技(上海)有限公司 2022-04-29 CN claimed
US-11246932-B2 Prostaglandin compositions and methods for the treatment of vasospasm NEXMED HOLDINGS, INC. (US) 2022-02-15 US claimed
WO-2021262779-A1 TOPICAL FORMULATIONS OF (1S)-1-PHENYL-2-PYRIDIN-2-YLETHANAMINE BIOHAVEN THERAPEUTICS LTD. (US) 2021-12-30 WO claimed
EP-3820452-A1 STABILIZED FORMULATIONS OF CANNABINOID COMPOSITIONS Berl, Volker (US) 2021-05-19 EP claimed
US-20210093646-A1 TOPICAL COMPOSITIONS COMPRISING BIMATOPROST AND METHODS FOR STIMULATING HAIR GROWTH THEREWITH ALLERGAN INC (US) 2021-04-01 US claimed
EP-1178833-A1 TOPICAL COMPOSITIONS FOR PROSTAGLANDIN E 1? DELIVERY Nexmed Holdings, Inc. (US) 2002-02-13 EP claimed
US-6323241-B1 PLACING IN THE FOSSA NAVICULARIS PROSATGLANDIN E1 AND A SKIN PENETRATION ENHANCER OF AMINOALKYLESTERS, GUM, LIPOPHILIC COMPOUND AND ACID BUFFER NEXMED (HOLDINGS) INC. 2001-11-27 US claimed
WO-2001074279-A1 TOPICAL COMPOSITIONS CONTAINING PROSTAGLANDIN E¿1? NEXMED HOLDINGS, INC. (US) 2001-10-11 WO claimed
WO-2001051053-A1 PROSTAGLANDIN COMPOSITIONS AND METHODS OF TREATMENT FOR MALE ERECTILE DYSFUNCTION NEXMED HOLDINGS, INC. (US) 2001-07-19 WO claimed
EP-1097126-A1 CRYSTALLINE SALTS OF DODECYL 2-(N,N-DIMETHYLAMINO)-PROPIONATE Nexmed Holdings, Inc. (US) 2001-05-09 EP claimed
WO-2000069469-A1 TOPICAL COMPOSITIONS FOR PROSTAGLANDIN E1 DELIVERY NEXMED HOLDINGS, INC. (US) 2000-11-23 WO claimed
WO-2000069809-A1 CRYSTALLINE SALTS OF DODECYL 2-(N,N-DIMETHYLAMINO)-PROPIONATE NEXMED HOLDINGS, INC. (US) 2000-11-23 WO claimed
US-6118020-A SALT FORMATION, PRECIPITATION, TRANSDERMAL DRUG DELIVERY PENETRATION AGENT NEXMED HOLDINGS, INC. (US) 2000-09-12 US claimed
US-6046244-A COMPOSITION COMPRISING PROSTAGLANDIN E1, SKIN PENETRATION ENHANCER, POLYSACCHARIDE GUM, LIPOPHILIC COMPOUND, ACIDIC BUFFER SYSTEM NEXMED HOLDINGS, INC. (US) 2000-04-04 US claimed
US-5861431-A Incontinence treatment IOTEK, INC. (US) 1999-01-19 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 (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-20210093646-A1 TOPICAL COMPOSITIONS COMPRISING BIMATOPROST AND METHODS FOR STIMULATING HAIR GROWTH THEREWITH FGF1, CYP21A2, HDGF NAAA 1678/4885EPHX1 1503/4885TSHR 494/4885
US-11246932-B2 Prostaglandin compositions and methods for the treatment of vasospasm PTGIS, PTGIR, PGF NAAA 2123/4885EPHX1 447/4885TSHR 2900/4885

“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.