SCHEMBL2422646

SCHEMBL2422646

CCCc1cc(C(=O)CO)ccc1OCCCCl

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 2/20 0.45
PLA2G2D Q9UNK4 1/20 0.43
THRA P10827 3/20 0.42
THRB P10828 2/20 0.42
PPARG P37231 7/20 0.41
PPARD Q03181 6/20 0.41
PPARA Q07869 6/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
LTB4R2 Q9NPC1 1/20 0.41

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
SCHEMBL6934988 0.95 LTB4R (0.42) LTB4RPLA2G2DTHRATHRBPPARG
SCHEMBL10522356 0.89 LTB4R (0.56) LTB4RPLA2G2DTHRATHRB
SCHEMBL6136991 0.88 LTB4R (0.44) LTB4RPLA2G2DTHRATHRBPPARG
SCHEMBL6935194 0.88 LTB4R (0.46) LTB4RPLA2G2DTHRATHRBPPARG
SCHEMBL8777238 0.88 LTB4R (0.44) LTB4RPLA2G2DTHRATHRBPPARG
SCHEMBL9387348 0.87 LTB4R (0.48) LTB4RPLA2G2DTHRATHRB
Hydrochloric Acid SCHEMBL9417918 0.86 LTB4R (0.45) LTB4RPLA2G2DTHRATHRBPPARG
SCHEMBL9821862 0.86 PLA2G2D (0.43) LTB4RPLA2G2DTHRATHRBPPARG
SCHEMBL9417841 0.85 THRA (0.52) LTB4RTHRATHRBPPARGPPARD
SCHEMBL5711634 0.84 LTB4R (0.53) LTB4RPLA2G2DTHRATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4202155-A None JP disclosed
JP-4202155-A None JP disclosed
US-8026282-B2 Phenoxyalkylcarboxylic acid derivatives in the treatment of irritable bowel syndrome MEDICINOVA, INC. (US) 2011-09-27 US disclosed
US-20100285074-A1 PHENOXYALKYLCARBOXYLIC ACID DERIVATIVES IN THE TREATMENT OF IRRITABLE BOWEL SYNDROME MEDICINOVA, INC. 2010-11-11 US disclosed
US-7786169-B2 Phenoxyalkycarboxylic acid derivatives in the treatment of ulcerative colitis MEDICINOVA, INC. (US) 2010-08-31 US disclosed
EP-1744740-A4 PHENOXYALKYCARBOXYLIC ACID DERIVATIVES IN THE TREATMENT OF INFLAMMATORY DISEASES MEDICINOVA INC (US) 2009-06-17 EP disclosed
US-20090093545-A1 PHENOXYALKYCARBOXYLIC ACID DERIVATIVES IN THE TREATMENT OF IRRITABLE BOWEL SYNDROME OR ULCERATIVE COLITIS MEDICINOVA, INC. 2009-04-09 US disclosed
US-7429617-B2 Phenoxyalkycarboxylic acid derivatives in the treatment of interstitial cystitis MEDICINOVA, INC. (US) 2008-09-30 US disclosed
EP-1744740-A1 PHENOXYALKYCARBOXYLIC ACID DERIVATIVES IN THE TREATMENT OF INFLAMMATORY DISEASES Medicinova, Inc. (US) 2007-01-24 EP disclosed
WO-2005105073-A1 PHENOXYALKYCARBOXYLIC ACID DERIVATIVES IN THE TREATMENT OF INFLAMMATORY DISEASES MEDICINOVA, INC. (US) 2005-11-10 WO disclosed
US-4908368-A SRS-A antagonist MURASE KIYOSHI (JP) 1990-03-13 US disclosed
US-4889871-A ANTIINFLAMMATORY AGENTS; SELECTIVE LEUKOTRIENE ANTAGONISTS G. D. SEARLE & CO. (US) 1989-12-26 US disclosed
US-4855310-A Thiadiazole compounds as antagonists of SRS-A YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1989-08-08 US disclosed
EP-0292977-A1 Alkoxy-substituted dihydrobenzopyran-2-carboxylate derivatives G.D. Searle & Co. (US) 1988-11-30 EP disclosed
US-4740514-A Tetrazole substituted compounds and their anti-allergic use LILLY INDUSTRIES LIMITED (GB) 1988-04-26 US disclosed
US-4714774-A ANTIASTHMATIC OR ANTIINFLAMMATORY AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1987-12-22 US disclosed
EP-0186440-A2 Method for producing benzoic acid derivatives Takeda Chemical Industries, Ltd. (JP) 1986-07-02 EP disclosed
US-4595540-A Benzonitrile and benzothiocyano intermediates LILLY INDUSTRIES LIMITED (GB) 1986-06-17 US disclosed
EP-0181779-A1 Heterocyclic compounds, their production, and medicaments containing them YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1986-05-21 EP disclosed
EP-0180416-A2 Benzoic acid analogues and their production Takeda Chemical Industries, Ltd. (JP) 1986-05-07 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 (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-20100285074-A1 PHENOXYALKYLCARBOXYLIC ACID DERIVATIVES IN THE TREATMENT OF IRRITABLE BOWEL SYNDROME SI, SLC10A2, HCAR2 LTB4R 262/4885PLA2G2D 2495/4885THRA 3035/4885
US-20090093545-A1 PHENOXYALKYCARBOXYLIC ACID DERIVATIVES IN THE TREATMENT OF IRRITABLE BOWEL SYNDROME OR ULCERATIVE COLITIS SI, HCAR2, SUCNR1 LTB4R 515/4885PLA2G2D 2974/4885THRA 2794/4885

“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.