SCHEMBL10706989

SCHEMBL10706989

Cc1cc2c(C(=O)O)c(C)c(C)c(C(=O)O)c2cc1C

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LDHA P00338 9/20 0.67
▸ LDHB P07195 8/20 0.67
▸ ALB P02768 2/20 0.46
▸ CYP3A4 P08684 2/20 0.45
▸ ACHE P22303 1/20 0.45
▸ PDE10A Q9Y233 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ NOTUM Q6P988 1/20 0.41
▸ TSHR P16473 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ GFER P55789 1/20 0.39
▸ MAPT P10636 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL32665238 0.90 LDHA (0.54) LDHALDHBALBCYP3A4ACHE
SCHEMBL7183958 0.81 LDHA (1.00) LDHALDHBALBCYP3A4ACHE
SCHEMBL6846916 0.80 LDHA (0.61) LDHALDHBALBCYP3A4ACHE
SCHEMBL7179558 0.76 LDHA (0.56) LDHALDHBALBCYP3A4ALDH1A1
SCHEMBL113091 0.75 PDE10A (0.62) LDHALDHBPDE10AALDH1A1TSHR
SCHEMBL1257863 0.75 CYP3A4 (0.50) LDHALDHBCYP3A4ACHEALDH1A1
SCHEMBL842692 0.74 NOTUM (0.42) LDHALDHBCYP3A4ACHEPDE10A
SCHEMBL238022 0.74 LDHA (0.48) LDHALDHBCYP3A4ACHEALDH1A1
SCHEMBL8106142 0.74 CYP3A4 (0.54) LDHALDHBCYP3A4ACHEALDH1A1
SCHEMBL11376422 0.73 LDHA (0.44) LDHALDHBALBCYP3A4ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180201629-A1 SEPARATION OF METAL-ORGANIC FRAMEWORKS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2018-07-19 — — US disclosed
US-10010860-B2 Production of metal-organic frameworks COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2018-07-03 — — US disclosed
US-9630163-B2 Production of metal-organic frameworks COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2017-04-25 — — US disclosed
US-20160346757-A1 Production of metal-organic frameworks COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2016-12-01 — — US disclosed
US-20160347774-A1 PRODUCTION OF METAL-ORGANIC FRAMEWORKS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2016-12-01 — — US disclosed
US-20160346756-A1 PRODUCTION OF METAL-ORGANIC FRAMEWORKS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2016-12-01 — — US disclosed
US-9139601-B2 Crystallisation facilitators for the synthesis of metal organic frameworks COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2015-09-22 — — US disclosed
US-20130204025-A1 CRYSTALLISATION FACILITATORS FOR THE SYNTHESIS OF METAL ORGANIC FRAMEWORKS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2013-08-08 — — US disclosed
US-8500889-B2 Gas adsorption material COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2013-08-06 — — US disclosed
US-7799120-B2 Metal-organic frameworks with exceptionally high capacity for storage of carbon dioxide at room-temperature THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2010-09-21 — — US disclosed
US-4643925-A PACKAGING FOODS AND BEVERAGES, CANS AND BOTTLES THE GOODYEAR TIRE & RUBBER COMPANY (US) 1987-02-17 — — US disclosed
EP-0105016-B1 POLYISOPHTHALATE AND COPOLYMERS THEREOF HAVING REDUCED CYCLIC DIMER CONTENT, AND A PROCESS FOR MAKING THE SAME THE GOODYEAR TIRE & RUBBER COMPANY (US) 1987-01-21 — — EP disclosed
US-4604257-A POLYESTERS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1986-08-05 — — US disclosed
US-4482586-A Multi-layer polyisophthalate and polyterephthalate articles and process therefor THE GOODYEAR TIRE & RUBBER COMPANY (US) 1984-11-13 — — US disclosed
EP-0105824-A1 Polyisophthalates and copolymers thereof having high barrier properties THE GOODYEAR TIRE & RUBBER COMPANY (US) 1984-04-18 — — EP disclosed
EP-0105825-A2 Multi-layer polyisophthalate and polyterephthalate articles and process therefor THE GOODYEAR TIRE & RUBBER COMPANY (US) 1984-04-18 — — EP disclosed
EP-0105016-A1 Polyisophthalate and copolymers thereof having reduced cyclic dimer content, and a process for making the same THE GOODYEAR TIRE & RUBBER COMPANY (US) 1984-04-04 — — EP disclosed
US-4424337-A Polyisophthalate and copolymers thereof having reduced cyclic dimer content, and a process for making the same THE GOODYEAR TIRE & RUBBER COMPANY (US) 1984-01-03 — — US disclosed
US-4418188-A PROTONIC ACID CATALYSTS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1983-11-29 — — US disclosed
US-4403090-A Polyisophthalates and copolymers thereof having high barrier properties THE GOODYEAR TIRE & RUBBER COMPANY (US) 1983-09-06 — — US 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 (5 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-20160346756-A1 PRODUCTION OF METAL-ORGANIC FRAMEWORKS OAT, CYP4F2, OSTC LDHA 421/4885LDHB 952/4885ALB 91/4885
US-20160346757-A1 Production of metal-organic frameworks OAT, CYP4F2, OSTC LDHA 421/4885LDHB 952/4885ALB 91/4885
US-20130204025-A1 CRYSTALLISATION FACILITATORS FOR THE SYNTHESIS OF METAL ORGANIC FRAMEWORKS MACF1, POF1B, MYB LDHA 3152/4885LDHB 3703/4885ALB 902/4885
US-20180201629-A1 SEPARATION OF METAL-ORGANIC FRAMEWORKS HNRNPF, HNRNPU, PUF60 LDHA 2828/4885LDHB 3399/4885ALB 110/4885
US-20160347774-A1 PRODUCTION OF METAL-ORGANIC FRAMEWORKS OAT, CYP4F2, OSTC LDHA 421/4885LDHB 952/4885ALB 91/4885

“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.

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