SCHEMBL2970612

SCHEMBL2970612

COc1cc2c(Nc3ccc(Sc4ccccn4)cc3)c(C#N)cnc2cc1F

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 8/20 0.61
EGFR P00533 11/20 0.61
ERBB2 P04626 9/20 0.61
SRC P12931 3/20 0.58
RAF1 P04049 1/20 0.57

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
SCHEMBL2968493 0.87 MAP2K1 (0.68) MAP2K1EGFRERBB2SRC
SCHEMBL2970665 0.81 MAP2K1 (0.73) MAP2K1EGFRERBB2SRCRAF1
SCHEMBL2976794 0.80 MAP2K1 (0.52) MAP2K1EGFRERBB2SRCRAF1
SCHEMBL2967767 0.78 MAP2K1 (0.71) MAP2K1EGFRERBB2SRCRAF1
SCHEMBL6185084 0.77 SRC (0.83) MAP2K1EGFRERBB2SRC
SCHEMBL6382185 0.77 MAP2K1 (1.00) MAP2K1EGFRERBB2SRCRAF1
SCHEMBL2977148 0.76 SRC (0.64) MAP2K1EGFRERBB2SRCRAF1
SCHEMBL6381464 0.76 EGFR (1.00) MAP2K1EGFRERBB2SRCRAF1
SCHEMBL28756490 0.76 MAP2K1 (0.95) MAP2K1EGFRERBB2SRCRAF1
SCHEMBL27614725 0.75 SRC (0.79) EGFRERBB2SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0788554-B1 SEQUENCE ANALYSIS OF SACCHARIDE MATERIAL CANCER RES CAMPAIGN TECH (GB) 2000-01-12 EP claimed
EP-0355831-B1 Purification of glycosaminoglycan degrading enzymes SEIKAGAKU KOGYO CO LTD (JP) 1994-01-26 EP claimed
US-5198355-A PURIFICATION OF GLYCOSAMINOGLYCAN DEGRADING ENZYMES WITH A SULFATED POLYSACCHARIDE SEIKAGAKU KOGYO CO., LTD. (JP) 1993-03-30 US claimed
EP-0355831-A2 Purification of glycosaminoglycan degrading enzymes SEIKAGAKU KOGYO CO., LTD. (JP) 1990-02-28 EP claimed
CN-114746556-A Compositions and methods for treating mountain phillips disease and other disorders 利索基因公司 2022-07-12 CN disclosed
US-20100291099-A1 NOVEL 27411, 23413, 22438, 23553, 25278, 26212, NARC SC1, NARC 10A, NARC 1, NARC 12, NARC 13, NARC17, NARC 25, NARC 3, NARC 4, NARC 7, NARC 8, NARC 11, NARC 14A, NARC 15, NARC 16, NARC 19, NARC 20, NARC 26, NARC 27, NARC 28, NARC 30, NARC 5, NARC 6, NARC 9, NARC 10C, NARC 8B, NARC 9, NARC2A, NARC 16B, NARC 1C, NARC 1A, NARC 25, 86604 AND 32222 MOLECULES AND USES THEREFOR MILLENNIUM PHARMACEUTICALS, INC. (US) 2010-11-18 US disclosed
US-7776577-B2 Ubiquitin protease MILLENNIUM PHARMACEUTICALS, INC. (US) 2010-08-17 US disclosed
US-7767671-B2 3-Quinolinecarbonitrile protein kinase inhibitors WYETH (US) 2010-08-03 US disclosed
US-20090269350-A1 Novel 27411, 23413, 22438, 23553, 25278, 26212, NARC SC1, NARC 10A, NARC 1, NARC 12, NARC 13, NARC17, NARC 25, NARC 3, NARC 4, NARC 7, NARC 8, NARC 11, NARC 14A, NARC 15, NARC 16, NARC 19, NARC 20, NARC 26, NARC 27, NARC 28, NARC 30, NARC 5, NARC 6, NARC 9, NARC 10C, NARC 8B, NARC 9, NARC2A, NARC 16B, NARC1C, NARC 1A, NARC 25, 86604 and 32222 molecules and uses therefor MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-10-29 US disclosed
US-20090062281-A1 3-QUINOLINECARBONITRILE PROTEIN KINASE INHIBITORS WYETH (US) 2009-03-05 US disclosed
US-7482147-B2 Ubiquitin protease MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-01-27 US disclosed
US-7449460-B2 3-Quinolinecarbonitrile protein kinase inhibitors WYETH (US) 2008-11-11 US disclosed
US-6767727-B2 FOR TREATMENT OF GENETIC DISORDERS; TARGETS FOR COMPETITIVE BINDING ASSAYS; DRUG SCREENING MILLENNIUM PHARMACEUTICALS, INC. 2004-07-27 US disclosed
US-20040009553-A1 Novel 27411, 23413, 22438, 23553, 25278, 26212, NARC SC1, NARC 10A, NARC 1, NARC 12, NARC 13, NARC17, NARC 25, NARC 3, NARC 4, NARC 7, NARC 8, NARC 11, NARC 14A, NARC 15, NARC 16, NARC 19, NARC 20, NARC 26, NARC 27, NARC 28, NARC 30, NARC 5, NARC 6, NARC 9, NARC 10C, NARC 8B, NARC 9, NARC2A, NARC 16B, NARC 1C, NARC1A, NARC 25, 86604 and 32222 molecules and uses therefor MILLENNIUM PHARMACEUTICALS, INC. 2004-01-15 US disclosed
US-20030162279-A1 22438, 23553, 25278, and 26212 novel human sulfatases MILLENNIUM PHARMACEUTICALS, INC. 2003-08-28 US disclosed
US-6534302-B1 Isolated nucleic acid molecule having specified nucleotide sequence or cDNA insert of specified plasmid, which encodes sulfatase, or its complement, or which encodes polypeptide having specified amino acid sequence MILLENNIUM PHARMACEUTICALS, INC. 2003-03-18 US disclosed
WO-2001055411-A9 HUMAN SULFATASES MILLENNIUM PHARM INC (US) 2003-01-09 WO disclosed
WO-2001055411-A2 HUMAN SULFATASES MILLENNIUM PHARMACEUTICALS, INC. (US) 2001-08-02 WO disclosed
US-5198355-A PURIFICATION OF GLYCOSAMINOGLYCAN DEGRADING ENZYMES WITH A SULFATED POLYSACCHARIDE SEIKAGAKU KOGYO CO., LTD. (JP) 1993-03-30 US disclosed
EP-0355831-A2 Purification of glycosaminoglycan degrading enzymes SEIKAGAKU KOGYO CO., LTD. (JP) 1990-02-28 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 (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-20090062281-A1 3-QUINOLINECARBONITRILE PROTEIN KINASE INHIBITORS RAF1, KRAS, NRAS MAP2K1 89/4885EGFR 895/4885ERBB2 885/4885

“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.