SCHEMBL4804548

SCHEMBL4804548

CCC=CCC=CCC=CCC=CCC=CCCCC(=O)Cl

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.69
CYP19A1 P11511 5/20 0.69
PPARG P37231 5/20 0.69
F7 P08709 3/20 0.69
F3 P13726 3/20 0.69
OXER1 Q8TDS5 3/20 0.69
KMT2A Q03164 3/20 0.69
PPARD Q03181 3/20 0.69
PPARA Q07869 3/20 0.69
PTGS1 P23219 3/20 0.69
ADORA3 P0DMS8 2/20 0.69
RXRA P19793 2/20 0.69
NR1I2 O75469 2/20 0.61
PTGS2 P35354 2/20 0.61
PGR P06401 1/20 0.61
PDE4D Q08499 1/20 0.61
MAPT P10636 4/20 0.59
CYP3A4 P08684 3/20 0.59
ALOX15 P16050 3/20 0.59
HSD17B10 Q99714 3/20 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
SCHEMBL9463025 1.00 ALDH1A1 (0.69) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL4804537 1.00 ALDH1A1 (0.69) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL9463022 1.00 ALDH1A1 (0.69) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL18555769 1.00 ALDH1A1 (0.69) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL38661876 1.00 ALDH1A1 (0.69) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL31027073 0.94 ALDH1A1 (0.68) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL10599248 0.92 ALDH1A1 (0.71) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL1971784 0.92 ALDH1A1 (0.71) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL8856775 0.92 ALDH1A1 (0.71) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL8856779 0.92 ALDH1A1 (0.71) ALDH1A1CYP19A1PPARGF7F3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025040089-A1 NOVEL HETEROCYCLIC COMPOUND FOR SELECTIVELY REGULATING CANNABINOID CB1 FUNCTION 德睿智药(苏州)新药研发有限公司 2025-02-27 WO disclosed
EP-3481383-B1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF IRRITABLE BOWEL SYNDROME CELLIX BIO PRIVATE LTD (IN) 2023-06-14 EP disclosed
US-9403826-B2 Compositions and methods for the treatment of inflammatory disorders CELLIX BIO PRIVATE LIMITED (IN) 2016-08-02 US disclosed
US-20160122283-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF METABOLIC SYNDROME CELLIX BIO PRIVATE LIMITED (IN) 2016-05-05 US disclosed
US-9321716-B1 Compositions and methods for the treatment of metabolic syndrome CELLIX BIO PRIVATE LIMITED (IN) 2016-04-26 US disclosed
US-9321775-B2 Compositions and methods for the treatment of moderate to severe pain CELLIX BIO PRIVATE LIMITED (IN) 2016-04-26 US disclosed
US-9315461-B2 Compositions and methods for the treatment of neurologic diseases CELLIX BIO PRIVATE LIMITED (IN) 2016-04-19 US disclosed
US-9284287-B1 Compositions and methods for the suppression of carbonic anhydrase activity CELLIX BIO PRIVATE LIMITED (IN) 2016-03-15 US disclosed
US-20150210667-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF AUTONOMIC AND OTHER NEUROLOGICAL DISORDERS KANDULA MAHESH (US) 2015-07-30 US disclosed
US-20150152057-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEUROLOGIC DISEASES CELLIX BIO PRIVATE LIMITED (IN) 2015-06-04 US disclosed
US-6555700-B1 Bioactives (drugs, nutrients) in a form in which they are lipophilic so that they can pass lipid barriers (membranes, skin etc.) in the body readily; glycerides of esterified, aminated or etherified bioactives; side effect reduction SCOTIA HOLDINGS PLC (GB) 2003-04-29 US disclosed
EP-0942738-B1 POLYETHYLENE GLYCOL ESTERS OF POLYUNSATURATED FATTY ACIDS SCARISTA LTD (GB) 2002-07-03 EP disclosed
US-6245811-B1 DIFFUSION THROUGH CELL BARRIERS SCOTIA HOLDINGS PLC (GB) 2001-06-12 US disclosed
US-6015821-A SKIN, PSYCHOLOGICAL AND CARDIOVASCULAR DISORDERS; ANTICARCINOGENIC, ANTIINFLAMMATORY AND ANTIDIABETIC AGENTS SCARISTA LIMITED (IM) 2000-01-18 US disclosed
WO-1998040059-A1 UNSATURATED FATTY ACID ANHYDRIDES FOR USE IN THERAPY SCOTIA HOLDINGS PLC (GB) 1998-09-17 WO disclosed
WO-1998013330-A1 ESTERS OF UNSATURATED FATTY ACIDS SCOTIA HOLDINGS PLC (GB) 1998-04-02 WO disclosed
US-5216023-A Antitumor agents, tyrosine kinase inhibitor FOLLIGEN BUDAPEST LTD. (HU) 1993-06-01 US disclosed
EP-0161422-B1 ALKANOLAMINE DERIVATIVES AND PLATELET AGGREGATION INHIBITORS CONTAINING THE SAME AS AN ACTIVE INGREDIENT TERUMO KABUSHIKI KAISHA trading as TERUMO CORPORATION (JP) 1989-03-01 EP disclosed
US-4619938-A Fatty acid derivatives of aminoalkyl nicotinic acid esters and platelet aggregation inhibitors TERUMO KABUSHIKI KAISHA (JP) 1986-10-28 US disclosed
EP-0161422-A1 Alkanolamine derivatives and platelet aggregation inhibitors containing the same as an active ingredient TERUMO KABUSHIKI KAISHA trading as TERUMO CORPORATION (JP) 1985-11-21 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 (3 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-20160122283-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF METABOLIC SYNDROME SLC5A1, SLC5A2, SLC2A1 ALDH1A1 436/4885CYP19A1 693/4885PPARG 405/4885
US-20150152057-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEUROLOGIC DISEASES MAPT, TARDBP, SLC6A11 ALDH1A1 1182/4885CYP19A1 924/4885PPARG 1663/4885
US-20150210667-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF AUTONOMIC AND OTHER NEUROLOGICAL DISORDERS FH, FAH, FAP ALDH1A1 750/4885CYP19A1 3133/4885PPARG 3063/4885

“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.