SCHEMBL656457

SCHEMBL656457

O=C(O)/C=C(/CCc1ccc2ccccc2c1)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 8/20 1.00
CYP1A2 P05177 1/20 0.55
FFAR1 O14842 1/20 0.47
SOX18 P35713 1/20 0.47
HDAC1 Q13547 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HCAR2 Q8TDS4 2/20 0.45
SLC13A5 Q86YT5 1/20 0.45
TBXA2R P21731 1/20 0.44
PTGER4 P35408 1/20 0.44
PTGFR P43088 1/20 0.44
PTGER3 P43115 1/20 0.44
PTGER2 P43116 1/20 0.44
PTGDR Q13258 1/20 0.44

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
SCHEMBL656458 1.00 PDPK1 (1.00) PDPK1CYP1A2FFAR1SOX18HDAC1
SCHEMBL656456 1.00 PDPK1 (1.00) PDPK1CYP1A2FFAR1SOX18HDAC1
SCHEMBL659544 0.93 PDPK1 (0.86) PDPK1CYP1A2FFAR1HDAC1HDAC8
SCHEMBL659542 0.93 PDPK1 (0.86) PDPK1CYP1A2FFAR1HDAC1HDAC8
SCHEMBL659543 0.93 PDPK1 (0.86) PDPK1CYP1A2FFAR1HDAC1HDAC8
SCHEMBL659760 0.87 PDPK1 (0.76) PDPK1CYP1A2FFAR1SOX18HCAR2
SCHEMBL659761 0.87 PDPK1 (0.76) PDPK1CYP1A2FFAR1SOX18HCAR2
SCHEMBL659762 0.87 PDPK1 (0.76) PDPK1CYP1A2FFAR1SOX18HCAR2
SCHEMBL658624 0.83 PDPK1 (0.71) PDPK1CYP1A2FFAR1
SCHEMBL658626 0.83 PDPK1 (0.71) PDPK1CYP1A2FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3936608-B1 REPROGRAMMING CELLS SCRIPPS RESEARCH INST (US) 2025-05-07 EP claimed
EP-3936608-A1 REPROGRAMMING CELLS The Scripps Research Institute (US) 2022-01-12 EP claimed
EP-3199623-B1 REPROGRAMMING CELLS SCRIPPS RESEARCH INST (US) 2021-07-28 EP claimed
CN-105176930-B Reprogramming cells 斯克里普斯研究所 2021-05-04 CN claimed
US-20210095257-A1 REPROGRAMMING CELLS THE SCRIPPS RESEARCH INSTITUTE 2021-04-01 US claimed
US-10738281-B2 Reprogramming cells THE SCRIPPS RESEARCH INSTITUTE (US) 2020-08-11 US claimed
US-20190203182-A1 REPROGRAMMING CELLS THE SCRIPPS RESEARCH INSTITUTE 2019-07-04 US claimed
US-20170283776-A1 REPROGRAMMING CELLS THE SCRIPPS RESEARCH INSTITUTE 2017-10-05 US claimed
EP-3199623-A1 REPROGRAMMING CELLS The Scripps Research Institute (US) 2017-08-02 EP claimed
US-9657274-B2 Reprogramming cells THE SCRIPPS RESEARCH INSTITUTE (US) 2017-05-23 US claimed
US-9315779-B2 Reprogramming cells THE SCRIPPS RESEARCH INSTITUTE (US) 2016-04-19 US claimed
EP-2349999-B1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIV SAARLAND (DE) 2016-01-27 EP claimed
US-8912186-B2 Allosteric protein kinase modulators UNIVERSITAET DES SAARLANDES (DE) 2014-12-16 US claimed
US-20130323833-A1 REPROGRAMMING CELLS THE SCRIPPS RESEARCH INSTITUTE 2013-12-05 US claimed
EP-2553086-A1 REPROGRAMMING CELLS The Scripps Research Institute (US) 2013-02-06 EP claimed
US-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2012-02-23 US claimed
WO-2011123572-A1 REPROGRAMMING CELLS THE SCRIPPS RESEARCH INSTITUTE (US) 2011-10-06 WO claimed
EP-2349999-A1 ALLOSTERIC PROTEIN KINASE MODULATORS Universität des Saarlandes (DE) 2011-08-03 EP claimed
WO-2010043711-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2010-04-22 WO claimed
EP-2177510-A1 Allosteric protein kinase modulators Universität des Saarlandes (DE) 2010-04-21 EP claimed

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-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS AURKC, AURKA, AURKB PDPK1 109/4885CYP1A2 4611/4885FFAR1 4188/4885

“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.