SCHEMBL959547

SCHEMBL959547

Cc1c(Cc2ccnc(N)c2F)c(=O)oc2cc(Oc3ncccn3)ccc12

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 13/20 0.72
RAF1 P04049 10/20 0.72
CYP2C9 P11712 2/20 0.72
BRAF P15056 2/20 0.72
MAP2K2 P36507 1/20 0.72
MAP2K5 Q13163 1/20 0.72
CYP3A4 P08684 1/20 0.66
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 3/20 0.48
HSD17B10 Q99714 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
GAA P10253 1/20 0.47
HPGD P15428 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MAOB P27338 1/20 0.45
STS P08842 1/20 0.45
ALDH1A2 O94788 1/20 0.43
ALDH1B1 P30837 1/20 0.43
ALDH1A3 P47895 1/20 0.43

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
SCHEMBL962208 0.93 MAP2K1 (0.63) MAP2K1RAF1CYP2C9BRAFMAP2K2
SCHEMBL26997739 0.90 MAP2K1 (0.77) MAP2K1RAF1CYP2C9BRAFMAP2K2
SCHEMBL964531 0.90 MAP2K1 (0.60) MAP2K1RAF1CYP2C9BRAFMAP2K2
SCHEMBL963618 0.90 MAP2K1 (0.72) MAP2K1RAF1CYP2C9BRAFMAP2K2
SCHEMBL26613741 0.89 MAP2K1 (0.59) MAP2K1RAF1CYP2C9BRAFMAP2K2
SCHEMBL965293 0.89 MAP2K1 (0.71) MAP2K1RAF1CYP2C9BRAFMAP2K2
SCHEMBL29842959 0.89 MAP2K1 (0.71) MAP2K1RAF1CYP2C9BRAFMAP2K2
SCHEMBL958376 0.89 MAP2K1 (0.62) MAP2K1RAF1CYP2C9BRAFMAP2K2
SCHEMBL12694075 0.88 MAP2K1 (0.82) MAP2K1RAF1CYP2C9BRAFMAP2K2
SCHEMBL959646 0.87 MAP2K1 (0.86) MAP2K1RAF1CYP2C9BRAFMAP2K2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11873296-B2 Solid forms of a dual RAF/MEK inhibitor VERASTEM, INC. (US) 2024-01-16 US disclosed
EP-3800471-A1 COMPOSITION FOR PROMOTING DIFFERENTIATION OF AND PROTECTING NEURAL STEM CELLS AND METHOD FOR INDUCING NEURAL REGENERATION USING SAME Genuv Inc. (KR) 2021-04-07 EP disclosed
WO-2021047798-A1 VS-6063 IN COMBINATION WITH CH5126766 FOR THE TREATMENT OF CANCER THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2021-03-18 WO disclosed
WO-2021048339-A1 VS-6063 IN COMBINATION WITH CH5126766 FOR THE TREATMENT OF CANCER THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2021-03-18 WO disclosed
EP-2754654-B1 METHOD FOR PRODUCING COUMARIN DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2018-05-30 EP disclosed
EP-2754654-B1 METHOD FOR PRODUCING COUMARIN DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2018-05-30 EP disclosed
US-9133174-B2 Method for producing coumarin derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2015-09-15 US disclosed
US-9133174-B2 Method for producing coumarin derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2015-09-15 US disclosed
US-9133174-B2 Method for producing coumarin derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2015-09-15 US disclosed
US-20140213786-A1 Method for Producing Coumarin Derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2014-07-31 US disclosed
US-7897792-B2 Coumarin derivative having antitumor activity CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2011-03-01 US disclosed
US-20110009398-A1 p27 Protein Inducer CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2011-01-13 US disclosed
US-20110009398-A1 p27 Protein Inducer CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2011-01-13 US disclosed
US-20110009398-A1 p27 Protein Inducer CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2011-01-13 US disclosed
EP-2172198-A1 p27 PROTEIN INDUCER Chugai Seiyaku Kabushiki Kaisha (JP) 2010-04-07 EP disclosed
US-20100004233-A1 NOVEL COUMARIN DERIVATIVE HAVING ANTITUMOR ACTIVITY CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2010-01-07 US disclosed
US-20100004233-A1 NOVEL COUMARIN DERIVATIVE HAVING ANTITUMOR ACTIVITY CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2010-01-07 US disclosed
US-20100004233-A1 NOVEL COUMARIN DERIVATIVE HAVING ANTITUMOR ACTIVITY CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2010-01-07 US disclosed
EP-1982982-A1 NOVEL COUMARIN DERIVATIVE HAVING ANTITUMOR ACTIVITY CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2008-10-22 EP disclosed
EP-1982982-A1 NOVEL COUMARIN DERIVATIVE HAVING ANTITUMOR ACTIVITY CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2008-10-22 EP 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 (4 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-20140213786-A1 Method for Producing Coumarin Derivative CYP3A7, CYP2B6, CYP7A1 MAP2K1 2570/4885RAF1 689/4885CYP2C9 27/4885
US-20110009398-A1 p27 Protein Inducer CDKN1A, CDK2, SKP2 MAP2K1 1179/4885RAF1 1656/4885CYP2C9 2989/4885
US-11873296-B2 Solid forms of a dual RAF/MEK inhibitor BRAF, RAF1, NRAS MAP2K1 5/4885RAF1 2/4885CYP2C9 872/4885
US-20100004233-A1 NOVEL COUMARIN DERIVATIVE HAVING ANTITUMOR ACTIVITY H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, SULT1A1, SULT1E1 MAP2K1 3163/4885RAF1 438/4885CYP2C9 448/4885

“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.