SCHEMBL4333469

SCHEMBL4333469

O=C(CCc1ccccc1)Nc1onc(-c2ccc(-c3ccccc3)cc2)c1-c1ccncc1

nearest known ligand 0.86

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.86
LMNA P02545 1/20 0.53
MLYCD O95822 3/20 0.45
KDM6B O15054 1/20 0.45
KDM4D Q6B0I6 1/20 0.45
KDM4C Q9H3R0 1/20 0.45
EGLN3 Q9H6Z9 1/20 0.45
ROCK2 O75116 1/20 0.45
ROCK1 Q13464 1/20 0.45
NPY5R Q15761 1/20 0.45
TDP1 Q9NUW8 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
SCHEMBL4334980 0.97 MAPK14 (0.88) MAPK14LMNAMLYCDKDM6BKDM4D
SCHEMBL4521201 0.93 MAPK14 (0.81) MAPK14LMNAMLYCDKDM6BKDM4D
SCHEMBL27765823 0.92 MAPK14 (0.80) MAPK14LMNAMLYCDKDM6BKDM4D
SCHEMBL4346595 0.92 MAPK14 (0.80) MAPK14LMNAMLYCDKDM6BKDM4D
SCHEMBL4341309 0.90 MAPK14 (0.77) MAPK14LMNA
SCHEMBL4340549 0.89 MAPK14 (0.85) MAPK14MLYCDROCK1
SCHEMBL4341935 0.89 MAPK14 (0.75) MAPK14LMNAMLYCDKDM6BKDM4D
SCHEMBL4336989 0.89 MAPK14 (0.75) MAPK14LMNAMLYCDKDM6BKDM4D
SCHEMBL4333402 0.88 MAPK14 (0.74) MAPK14LMNAKDM6BKDM4DKDM4C
SCHEMBL4331942 0.88 MAPK14 (0.74) MAPK14LMNAMLYCD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8207203-B2 Pyridylisoxazole derivatives ASKA PHARMACEUTICAL CO., LTD. (JP) 2012-06-26 US disclosed
US-20090306145-A1 Pyridylisoxazole Derivatives ASKA PHARMACEUTICAL CO., LTD. (JP) 2009-12-10 US disclosed
CN-101472921-A Pyridylisoxazole derivative ASKA PHARM CO LTD (JP) 2009-07-01 CN disclosed
EP-2036905-A1 PYRIDYLISOXAZOLE DERIVATIVE ASKA Pharmaceutical Co., Ltd. (JP) 2009-03-18 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-20090306145-A1 Pyridylisoxazole Derivatives CNKSR1, MAPK1, MAPK3 MAPK14 43/4885LMNA 4792/4885MLYCD 4475/4885

“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.