SCHEMBL601354

SCHEMBL601354

Cc1ccccc1-c1nncc2cc(Nc3ccccc3)ccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 10/20 0.47
KIT P10721 3/20 0.47
MAPK10 P53779 2/20 0.47
MAPK9 P45984 1/20 0.47
CYP3A4 P08684 4/20 0.45
LCK P06239 2/20 0.41
KDR P35968 2/20 0.41
ALDH1A1 P00352 3/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CYP1A2 P05177 2/20 0.40
CYP2D6 P10635 2/20 0.40
TSHR P16473 2/20 0.40
CYP2C19 P33261 2/20 0.40
MAPK1 P28482 1/20 0.40
CLK4 Q9HAZ1 1/20 0.40
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
SCN9A Q15858 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL599999 0.87 MAPK14 (0.49) MAPK14KITMAPK10MAPK9CYP3A4
SCHEMBL599637 0.81 MAPK14 (0.69) MAPK14KITMAPK10MAPK9LCK
SCHEMBL599677 0.80 MAPK14 (0.54) MAPK14KDRSCN9A
SCHEMBL607542 0.79 MAPK14 (0.47) MAPK14KDRSCN9A
SCHEMBL2945976 0.79 MAPK14 (0.60) MAPK14KITMAPK10MAPK9CYP3A4
SCHEMBL2945468 0.78 MAPK14 (0.48) MAPK14KITMAPK10MAPK9CYP3A4
SCHEMBL599750 0.77 MAPK14 (0.46) MAPK14KDRSCN9ANPSR1
SCHEMBL599476 0.77 MAPK14 (0.56) MAPK14MAPK10CYP3A4KDRALDH1A1
SCHEMBL29941671 0.77 MAPK14 (0.48) MAPK14KITMAPK10MAPK9CYP3A4
SCHEMBL600366 0.76 KDR (0.47) MAPK14CYP3A4KDRALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8497269-B2 Phthalazine compounds as p38 map kinase modulators and methods of use thereof AMGEN INC. (US) 2013-07-30 US claimed
US-20120040983-A1 Phthalazine Compounds as P38 Map Kinase Modulators and Methods of Use Thereof AMGEN INC. (US) 2012-02-16 US claimed
WO-2010042649-A2 PHTHALAZINE COMPOUNDS AS p38 MAP KINASE MODULATORS AND METHODS OF USE THEREOF AMGEN INC. (US) 2010-04-15 WO claimed
US-8497269-B2 Phthalazine compounds as p38 map kinase modulators and methods of use thereof AMGEN INC. (US) 2013-07-30 US disclosed
US-20120040983-A1 Phthalazine Compounds as P38 Map Kinase Modulators and Methods of Use Thereof AMGEN INC. (US) 2012-02-16 US disclosed
WO-2010042649-A2 PHTHALAZINE COMPOUNDS AS p38 MAP KINASE MODULATORS AND METHODS OF USE THEREOF AMGEN INC. (US) 2010-04-15 WO 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-20120040983-A1 Phthalazine Compounds as P38 Map Kinase Modulators and Methods of Use Thereof MAPK1, MAPK4, MAPK12 MAPK14 26/4885KIT 3969/4885MAPK10 41/4885

“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.