SCHEMBL10102287

SCHEMBL10102287

O=C(Oc1ccccc1)c1c(Cc2ccc(OC(F)(F)F)cc2)cncc1OCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
RXRG P48443 1/20 0.43
CYP11B1 P15538 2/20 0.43
CYP11B2 P19099 2/20 0.43
MRGPRX4 Q96LA9 2/20 0.42
FFAR1 O14842 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
GPR132 Q9UNW8 1/20 0.40
SLC6A4 P31645 1/20 0.39
TSHR P16473 1/20 0.39
PTGER1 P34995 2/20 0.38
CYP19A1 P11511 1/20 0.38
PPARG P37231 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
SCHEMBL10107912 0.88 CYP11B1 (0.41) CYP11B1CYP11B2FFAR1FFAR4SLC6A4
SCHEMBL10102283 0.81 AOC3 (0.45) TSHRPTGER1
SCHEMBL10102300 0.78 TSHR (0.39) TSHRPTGER1
SCHEMBL113440 0.76 P2RX7 (0.45) RXRARXRBMRGPRX4TSHRPTGER1
SCHEMBL112286 0.76 P4HTM (0.44) RXRARXRBRXRGFFAR4TSHR
SCHEMBL10101771 0.69 MAPT (0.42) RXRARXRBRXRGTSHRPTGER1
SCHEMBL2447727 0.69 RXRA (0.63) RXRARXRBRXRGMRGPRX4
SCHEMBL4380372 0.69 MRGPRX4 (0.57) RXRARXRBRXRGMRGPRX4FFAR1
SCHEMBL18531665 0.69 RXRA (0.40) RXRARXRBRXRGMRGPRX4
SCHEMBL11920820 0.68 PTPN1 (0.46) RXRARXRBRXRGMRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8828988-B2 8-AZA tetracycline compounds TETRAPHASE PHARMACEUTICALS, INC. (US) 2014-09-09 US disclosed
US-8367654-B2 8-AZA tetracycline compounds TETRAPHASE PHARMACEUTICALS, INC. (US) 2013-02-05 US disclosed
US-20120108569-A1 8-AZA Tetracycline Compounds TETRAPHASE PHARMACEUTICALS, INC. 2012-05-03 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-20120108569-A1 8-AZA Tetracycline Compounds TET1, TET3, HDAC8 RXRA 1581/4885RXRB 2160/4885RXRG 2132/4885

“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.