SCHEMBL16769640

SCHEMBL16769640

Cc1c(-c2ccc(C(=O)O)cc2)cc(-c2ccc(OC=O)cc2)cc1-c1ccc(C(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RXRA P19793 9/20 0.49
RXRB P28702 6/20 0.49
HSD17B10 Q99714 1/20 0.46
MAP4K4 O95819 2/20 0.46
ERN1 O75460 1/20 0.43
RXRG P48443 1/20 0.42
RARB P10826 4/20 0.41
RARG P13631 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
RARA P10276 1/20 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
SCHEMBL16769645 0.87 MAP4K4 (0.50) RXRARXRBHSD17B10MAP4K4ERN1
SCHEMBL14961176 0.87 ERN1 (0.47) RXRARXRBHSD17B10MAP4K4ERN1
SCHEMBL14961177 0.87 ERN1 (0.47) RXRARXRBHSD17B10MAP4K4ERN1
SCHEMBL18504207 0.86 HSD17B10 (0.49) RXRARXRBHSD17B10MAP4K4ERN1
SCHEMBL12535966 0.86 RXRA (0.54) RXRARXRBHSD17B10ERN1RXRG
SCHEMBL10260784 0.86 RXRA (0.54) RXRARXRBHSD17B10ERN1RXRG
SCHEMBL16769649 0.86 RXRA (0.54) RXRARXRBHSD17B10ERN1RXRG
SCHEMBL15132369 0.85 RXRA (0.56) RXRARXRBHSD17B10MAP4K4ERN1
SCHEMBL16769650 0.85 RARB (0.50) RXRARXRBHSD17B10MAP4K4RARB
SCHEMBL16749637 0.84 RXRA (0.66) RXRARXRBMAP4K4RXRGRARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9951095-B2 Chromium metal organic frameworks and synthesis of metal organic frameworks THE TEXAS A&M UNIVERSITY SYSTEM (US) 2018-04-24 US disclosed
US-9724668-B2 Iron metal organic framework materials THE TEXAS A&M UNIVERSITY SYSTEM (US) 2017-08-08 US disclosed
US-20170050995-A1 Chromium Metal Organic Frameworks and Synthesis of Metal Organic Frameworks THE TEXAS A&M UNIVERSITY SYSTEM 2017-02-23 US disclosed
US-20160346759-A1 Iron Metal Organic Framework Materials U.S. DEPARTMENT OF ENERGY 2016-12-01 US disclosed
US-9102691-B2 Aluminum metal organic framework materials TEXAS A&M UNIVERSITY SYSTEM (US) 2015-08-11 US disclosed
US-20150152123-A1 Aluminum Metal Organic Framework Materials U.S. DEPARTMENT OF ENERGY 2015-06-04 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 (3 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-20170050995-A1 Chromium Metal Organic Frameworks and Synthesis of Metal Organic Frameworks OXGR1, TFRC, PICALM RXRA 2502/4885RXRB 3146/4885HSD17B10 3807/4885
US-20160346759-A1 Iron Metal Organic Framework Materials TFRC, FTH1, FECH RXRA 4751/4885RXRB 4820/4885HSD17B10 4292/4885
US-20150152123-A1 Aluminum Metal Organic Framework Materials AS3MT, ORAI2, ORAI3 RXRA 4007/4885RXRB 4678/4885HSD17B10 3999/4885

“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.