SCHEMBL1683754

SCHEMBL1683754

COc1cc(OC)cc(C(=O)c2csc(C3=CCCC=C3)n2)c1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FGFR2 P21802 3/20 0.38
FGFR3 P22607 3/20 0.38
EGFR P00533 1/20 0.38
HDAC3 O15379 8/20 0.37
HDAC1 Q13547 8/20 0.37
HDAC7 Q8WUI4 8/20 0.37
HDAC8 Q9BY41 8/20 0.37
HDAC6 Q9UBN7 8/20 0.37
ALDH1A1 P00352 1/20 0.37
FGFR1 P11362 1/20 0.36
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
CYP1A1 P04798 1/20 0.35
CYP1B1 Q16678 1/20 0.35

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
SCHEMBL1683709 0.89 CNR2 (0.48) FGFR2FGFR3ALDH1A1TP53MAPT
SCHEMBL1683643 0.88 ALDH1A1 (0.41) HDAC3HDAC1HDAC7HDAC8HDAC6
SCHEMBL1683954 0.86 EGFR (0.53) EGFRHDAC3HDAC1HDAC7HDAC8
SCHEMBL4423934 0.83 ALDH1A1 (0.50) EGFRHDAC3HDAC1HDAC7HDAC8
SCHEMBL4424310 0.78 FGFR2 (0.38) FGFR2FGFR3FGFR1MAPT
SCHEMBL4427216 0.77 CNR2 (0.47) ALDH1A1TP53MAPT
SCHEMBL1683751 0.77 HDAC1 (0.37) FGFR2FGFR3HDAC1HDAC8HDAC6
SCHEMBL1683879 0.76 HPGD (0.38) EGFRHDAC3HDAC1HDAC7HDAC8
SCHEMBL9954603 0.76 ALDH1A1 (0.45) HDAC1HDAC8HDAC6ALDH1A1
SCHEMBL1683625 0.74 ALDH1A1 (0.52) EGFRHDAC3HDAC1HDAC7HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10865196-B2 Compounds for treatment of cancer UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2020-12-15 US disclosed
US-10301285-B2 Compounds for treatment of cancer GTX, INC. (US) 2019-05-28 US disclosed
US-20190092755-A1 COMPOUNDS FOR TREATMENT OF CANCER ONCTERNAL THERAPEUTICS, INC 2019-03-28 US disclosed
EP-2303021-B1 COMPOUNDS FOR THE TREATMENT OF CANCER UNIV TENNESSEE RES FOUND (US) 2018-12-19 EP disclosed
US-20180093971-A1 COMPOUNDS FOR TREATMENT OF CANCER ONCTERNAL THERAPEUTICS, INC 2018-04-05 US disclosed
EP-3289876-A1 COMPOUNDS FOR TREATMENT OF CANCER University of Tennessee Research Foundation (US) 2018-03-07 EP disclosed
EP-2959900-A1 COMPOUND FOR TREATMENT OF CANCER University of Tennessee Research Foundation (US) 2015-12-30 EP disclosed
US-9029408-B2 Compounds for treatment of cancer GTX, INC. (US) 2015-05-12 US disclosed
US-20140213623-A1 COMPOUNDS FOR TREATMENT OF CANCER GTX, INC. (US) 2014-07-31 US disclosed
US-8592465-B2 Compounds for treatment of cancer UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2013-11-26 US disclosed
EP-2303021-A2 COMPOUNDS FOR THE TREATMENT OF CANCER University of Tennessee Research Foundation (US) 2011-04-06 EP disclosed
WO-2010074776-A2 COMPOUNDS FOR THE TREATMENT OF CANCER THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2010-07-01 WO disclosed
US-20090326020-A1 COMPOUNDS FOR TREATMENT OF CANCER UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2009-12-31 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 (6 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-20090326020-A1 COMPOUNDS FOR TREATMENT OF CANCER HCCS, NQO1, CCNY FGFR2 852/4885FGFR3 601/4885EGFR 263/4885
US-10865196-B2 Compounds for treatment of cancer CYP19A1, CYP17A1, SOX18 FGFR2 346/4885FGFR3 525/4885EGFR 520/4885
US-10301285-B2 Compounds for treatment of cancer CYP19A1, CYP17A1, SOX18 FGFR2 346/4885FGFR3 525/4885EGFR 520/4885
US-20140213623-A1 COMPOUNDS FOR TREATMENT OF CANCER CYP19A1, CYP17A1, SOX18 FGFR2 346/4885FGFR3 525/4885EGFR 520/4885
US-20180093971-A1 COMPOUNDS FOR TREATMENT OF CANCER CYP19A1, CYP17A1, SOX18 FGFR2 346/4885FGFR3 525/4885EGFR 520/4885
US-20190092755-A1 COMPOUNDS FOR TREATMENT OF CANCER CYP19A1, CYP17A1, SOX18 FGFR2 346/4885FGFR3 525/4885EGFR 520/4885

“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.