SCHEMBL18364464

SCHEMBL18364464

Cc1cc(-c2ccc(C(=O)O)c(O)c2)ccc1C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HNF4A P41235 1/20 0.67
▸ ACMSD Q8TDX5 1/20 0.67
▸ MCL1 Q07820 2/20 0.61
▸ RXRB P28702 2/20 0.60
▸ RXRA P19793 1/20 0.58
▸ ALDH1A1 P00352 2/20 0.53
▸ CA12 O43570 1/20 0.53
▸ CA1 P00915 1/20 0.53
▸ CA2 P00918 1/20 0.53
▸ TSHR P16473 1/20 0.53
▸ CA7 P43166 1/20 0.53
▸ CA9 Q16790 1/20 0.53
▸ CA14 Q9ULX7 1/20 0.53
▸ XDH P47989 4/20 0.53
▸ SLC22A12 Q96S37 3/20 0.53
▸ RARB P10826 1/20 0.53
▸ MAPT P10636 2/20 0.50
▸ MYC P01106 1/20 0.50
▸ KLKB1 P03952 1/20 0.50
▸ CTSB P07858 1/20 0.50

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
SCHEMBL18719593 0.93 HNF4A (0.59) HNF4AACMSDMCL1RXRBRXRA
SCHEMBL18719594 0.92 HNF4A (0.57) HNF4AACMSDMCL1RXRBRXRA
SCHEMBL18719595 0.91 HNF4A (0.56) HNF4AACMSDMCL1RXRBRXRA
SCHEMBL1498034 0.90 RXRB (0.70) HNF4AACMSDMCL1RXRBRXRA
SCHEMBL29771992 0.90 RXRB (0.70) HNF4AACMSDMCL1RXRBRXRA
SCHEMBL18719599 0.90 HNF4A (0.54) HNF4AACMSDMCL1RXRBRXRA
Hydrochloric Acid SCHEMBL9150803 0.88 RXRB (0.68) HNF4AACMSDMCL1RXRBRXRA
Hydrochloric Acid SCHEMBL4365452 0.88 RXRB (0.68) HNF4AACMSDMCL1RXRBRXRA
SCHEMBL2773864 0.88 ACMSD (0.83) HNF4AACMSDMCL1ALDH1A1CA12
SCHEMBL29441950 0.88 ACMSD (0.83) HNF4AACMSDMCL1ALDH1A1CA12

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170008915-A1 ACID, SOLVENT, AND THERMAL RESISTANT METAL-ORGANIC FRAMEWORKS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2017-01-12 — — 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 (1 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-20170008915-A1 ACID, SOLVENT, AND THERMAL RESISTANT METAL-ORGANIC FRAMEWORKS HAO2, ASF1A, FTO HNF4A 1553/4885ACMSD 1604/4885MCL1 1632/4885

“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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