SCHEMBL900744

SCHEMBL900744

Cc1cc(-c2cc(C)c(C(=O)O)c(C)c2)cc(C)c1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.54
ACHE P22303 1/20 0.54
ALDH1A1 P00352 5/20 0.50
MAPK1 P28482 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
MAPT P10636 2/20 0.45
NOTUM Q6P988 1/20 0.44
LDHA P00338 2/20 0.43
LDHB P07195 2/20 0.43
RXRB P28702 3/20 0.41
RXRA P19793 2/20 0.41
KDM4E B2RXH2 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MCL1 Q07820 1/20 0.41
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 2/20 0.40

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
Hydrochloric Acid SCHEMBL4355572 0.97 CYP3A4 (0.52) CYP3A4ACHEALDH1A1MAPK1SMN1; SMN2
SCHEMBL17177741 0.97 CYP3A4 (0.52) CYP3A4ACHEALDH1A1MAPK1SMN1; SMN2
SCHEMBL6061524 0.91 CA1 (0.64) CYP3A4ACHEALDH1A1MAPK1SMN1; SMN2
SCHEMBL19435461 0.91 RXRB (0.55) CYP3A4ACHEALDH1A1MAPK1SMN1; SMN2
SCHEMBL2882724 0.89 KDM4E (0.47) CYP3A4ACHEALDH1A1SMN1; SMN2MAPT
SCHEMBL4659030 0.85 MCL1 (0.48) CYP3A4ACHEALDH1A1MAPK1SMN1; SMN2
SCHEMBL377596 0.83 KDM4E (0.55) CYP3A4ACHEALDH1A1MAPK1SMN1; SMN2
SCHEMBL21870 0.83 KDM4E (0.55) CYP3A4ACHEALDH1A1MAPK1SMN1; SMN2
SCHEMBL3757424 0.83 NAPRT (0.43) CYP3A4ACHEALDH1A1MAPK1SMN1; SMN2
SCHEMBL4355570 0.81 CA1 (0.43) CYP3A4ACHEALDH1A1MAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113801336-B Functionalization of metal organic framework material UiO-67-4Me, functionalized product and application thereof 中山大学 2022-06-24 CN claimed
US-5342904-A Polymer modified adducts of epoxy resins and active hydrogen containing compounds containing mesogenic moieties THE DOW CHEMICAL COMPANY (US) 1994-08-30 US claimed
US-5235008-A Curable THE DOW CHEMICAL COMPANY (US) 1993-08-10 US claimed
CN-113801336-B Functionalization of metal organic framework material UiO-67-4Me, functionalized product and application thereof 中山大学 2022-06-24 CN disclosed
CN-113801336-A Functionalization of metal organic framework material UiO-67-4Me, functionalized product and application thereof 中山大学 2021-12-17 CN disclosed
US-10738068-B2 Organic/inorganic hybrid nanoparticulates made from iron carboxylates Centre National de la Recherche Scientifique—CNRS (FR) 2020-08-11 US disclosed
US-10738068-B2 Organic/inorganic hybrid nanoparticulates made from iron carboxylates Centre National de la Recherche Scientifique—CNRS (FR) 2020-08-11 US disclosed
US-20190211202-A1 ADDUCTS AND USES THEREOF HUNTSMAN ADVANCED MATERIALS AMERICAS LLC 2019-07-11 US disclosed
EP-3500627-A1 ADDUCTS AND USES THEREOF Huntsman Advanced Materials Americas LLC (US) 2019-06-26 EP disclosed
US-20180346500-A1 ORGANIC/INORGANIC HYBRID NANOPARTICULATES MADE FROM IRON CARBOXYLATES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2018-12-06 US disclosed
EP-2726530-B1 HYBRID EPOXY RESIN ADDUCTS BLUE CUBE IP LLC (US) 2018-09-12 EP disclosed
US-20040116619-A1 Polyester resins with improved properties POLYMERS AUSTRALIA PTY LIMITED (AU) 2004-06-17 US disclosed
EP-1317497-A1 POLYESTER RESINS WITH IMPROVED PROPERTIES Polymers Australia PTY Limited (AU) 2003-06-11 EP disclosed
WO-2002022705-A1 POLYESTER RESINS WITH IMPROVED PROPERTIES POLYMERS AUSTRALIA PTY LTD (AU) 2002-03-21 WO disclosed
US-5602211-A CURING AGENTS THE DOW CHEMICAL COMPANY (US) 1997-02-11 US disclosed
US-5414121-A Adducts of epoxy resins and active hydrogen containing compounds containing mesogenic moieties THE DOW CHEMICAL COMPANY (US) 1995-05-09 US disclosed
US-5276184-A Curing agents for epoxy resins for thermosetting resins THE DOW CHEMICAL COMPANY (US) 1994-01-04 US disclosed
US-5235008-A Curable THE DOW CHEMICAL COMPANY (US) 1993-08-10 US disclosed
EP-0478918-A2 Adducts of epoxy resins and active hydrogen containing compounds containing mesogenic moieties THE DOW CHEMICAL COMPANY (US) 1992-04-08 EP disclosed
EP-0469492-A2 Polymer modified adducts of epoxy resins and active hydrogen containing compounds containing mesogenic moieties THE DOW CHEMICAL COMPANY (US) 1992-02-05 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-20180346500-A1 ORGANIC/INORGANIC HYBRID NANOPARTICULATES MADE FROM IRON CARBOXYLATES SLC39A3, SLC40A1, AOC3 CYP3A4 1537/4885ACHE 2206/4885ALDH1A1 502/4885
US-10738068-B2 Organic/inorganic hybrid nanoparticulates made from iron carboxylates SLC40A1, FECH, FTH1 CYP3A4 1954/4885ACHE 2179/4885ALDH1A1 301/4885

“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.