SCHEMBL6556141

SCHEMBL6556141

CC(C)(Oc1ccc(CC(=O)Nc2cc(Cl)cc(Cl)c2)cc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 10/20 0.61
▸ MEN1 O00255 4/20 0.55
▸ KMT2A Q03164 4/20 0.55
▸ MAPT P10636 3/20 0.55
▸ CYP1A2 P05177 1/20 0.55
▸ CYP3A4 P08684 1/20 0.55
▸ CYP2D6 P10635 1/20 0.55
▸ CYP2C19 P33261 1/20 0.55
▸ PPARG P37231 4/20 0.52
▸ RORC P51449 1/20 0.51
▸ ALDH1A1 P00352 4/20 0.50
▸ PPARD Q03181 3/20 0.50
▸ FABP2 P12104 2/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ SLC22A12 Q96S37 1/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ NLRP3 Q96P20 1/20 0.46
▸ RAB9A P51151 1/20 0.45
▸ TBXAS1 P24557 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.44

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
SCHEMBL6558060 0.89 PPARA (0.57) PPARAMEN1KMT2AMAPTCYP1A2
SCHEMBL6557438 0.89 PPARA (0.69) PPARAMEN1KMT2AMAPTCYP1A2
SCHEMBL6555975 0.89 PPARA (0.69) PPARAMEN1KMT2AMAPTCYP1A2
SCHEMBL9614371 0.88 PPARA (0.54) PPARAMEN1KMT2AMAPTCYP1A2
Efaproxiral SCHEMBL1649963 0.86 PPARA (0.54) PPARAMEN1KMT2AMAPTCYP1A2
Efaproxiral SCHEMBL3768310 0.85 PPARA (0.52) PPARAMEN1KMT2AMAPTCYP1A2
SCHEMBL6557488 0.84 RAB9A (0.59) PPARAMEN1KMT2AMAPTPPARG
SCHEMBL1304059 0.83 SMN1; SMN2 (0.54) PPARAMEN1KMT2AMAPTCYP1A2
SCHEMBL6558056 0.82 SMN1; SMN2 (0.58) PPARAMEN1KMT2AMAPTPPARG
SCHEMBL1306107 0.82 PPARA (0.60) PPARAMEN1KMT2AMAPTCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5122539-A Allosteric hemoglobin modifiers useful for decreasing oxygen affinity and preserving oxygen carrying capability of stored blood CENTER FOR INNOVATIVE TECHNOLOGY (US) 1992-06-16 — — US claimed
US-20240122977-A1 COMPOSITIONS AND METHODS FOR PARENTERAL ADMINISTRATION OF THERAPEUTIC AGENTS EPICENTRX, INC. 2024-04-18 — — US disclosed
CN-111511350-B Compositions for parenteral administration of therapeutic agents 埃皮辛特瑞柯斯公司 2023-10-13 — — CN disclosed
US-11744859-B2 Compositions and methods for parenteral administration of therapeutic agents EPICENTRX, INC. (US) 2023-09-05 — — US disclosed
EP-1468680-A2 Using allosteric hemoglobin modifiers to decrease oxygen affinity in blood Virginia Commonwealth University Intellectual Property Foundation, Inc. (US) 2004-10-20 — — EP disclosed
EP-0585366-B1 USING ALLOSTERIC HEMOGLOBIN MODIFIERS TO DECREASE OXYGEN AFFINITY IN BLOOD UNIV VIRGINIA COMMONWEALTH (US) 2004-04-28 — — EP disclosed
EP-1236711-B1 Using allosteric hemoglobin modifiers to decrease oxygen affinity in blood UNIV VIRGINIA COMMONWEALTH (US) 2004-03-03 — — EP disclosed
EP-1236711-A2 Using allosteric hemoglobin modifiers to decrease oxygen affinity in blood Virginia Commonwealth University Intellectual Property Foundation, Inc. (US) 2002-09-04 — — EP disclosed
US-5927283-A TREATING DISEASES INVOLVING OXYGEN DEFICIENCY, IN WOUND HEALING, AND IN RESTORING OXYGEN AFFINITY OF STORED BLOOD. VIRGINIA COMMONWEALTH UNIVERSITY (US) 1999-07-27 — — US disclosed
US-5872282-A MAINTAIN OXYGEN AFFINITY IN BLOOD WHEN STORED VIRGINIA COMMONWEALTH UNIVERSITY (US) 1999-02-16 — — US disclosed
EP-0471811-B1 ALLOSTERIC HEMOGLOBIN MODIFIERS INNOVATIVE TECH CENTER (US) 1995-12-27 — — EP disclosed
US-5432191-A Ring-substituted phenoxymethyl /or substituted methyl/ carboxylates THE CENTER FOR INNOVATIVE TECHNOLOGY (US) 1995-07-11 — — US disclosed
EP-0585366-A4 USING ALLOSTERIC HEMOGLOBIN MODIFIERS TO DECREASE OXYGEN AFFINITY IN BLOOD. CT FOR INNOVATIVE TECHNOLOGY (US) 1994-03-17 — — EP disclosed
EP-0585366-A1 USING ALLOSTERIC HEMOGLOBIN MODIFIERS TO DECREASE OXYGEN AFFINITY IN BLOOD CENTER FOR INNOVATIVE TECHNOLOGY (US) 1994-03-09 — — EP disclosed
US-5290803-A Using allosteric hemoglobin modifiers to decrease oxygen affinity in blood THE CENTER OF INNOVATIVE TECHNOLOGY (US) 1994-03-01 — — US disclosed
US-5250701-A 2-(Phthalomidomethylphenoxyalkanoic acid or ester; wound healing agents; antiischemic agents; blood storage; antidepressants; Alzheimer's disease; schizophrenia CENTER FOR INNOVATIVE TECHNOLOGY (US) 1993-10-05 — — US disclosed
US-5248785-A Using allosteric hemoglobin modifiers to decrease oxygen affinity in blood VIRGINIA COMMONWEALTH UNIVERSITY (US) 1993-09-28 — — US disclosed
WO-1992020335-A1 USING ALLOSTERIC HEMOGLOBIN MODIFIERS TO DECREASE OXYGEN AFFINITY IN BLOOD CENTER FOR INNOVATIVE TECHNOLOGY (US) 1992-11-26 — — WO disclosed
US-5122539-A Allosteric hemoglobin modifiers useful for decreasing oxygen affinity and preserving oxygen carrying capability of stored blood CENTER FOR INNOVATIVE TECHNOLOGY (US) 1992-06-16 — — US disclosed
US-5049695-A Substituted diphenyl carbamates CENTER FOR INNOVATIVE TECHNOLOGY (US) 1991-09-17 — — US disclosed
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