SCHEMBL4337176

SCHEMBL4337176

O=C(CCc1ccccc1)Nc1onc(-c2ccc(F)cc2F)c1-c1ccncc1

nearest known ligand 0.77

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 12/20 0.77
RAB9A P51151 2/20 0.50
POLB P06746 1/20 0.50
LMNA P02545 1/20 0.46
NPC1 O15118 2/20 0.41
RORC P51449 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
HCAR2 Q8TDS4 1/20 0.40

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
SCHEMBL4342449 0.91 MAPK14 (0.69) MAPK14RAB9ALMNANPC1RORC
SCHEMBL4339849 0.91 MAPK14 (0.75) MAPK14RAB9APOLBLMNA
SCHEMBL4333020 0.90 MAPK14 (0.76) MAPK14POLB
SCHEMBL4334957 0.90 MAPK14 (0.74) MAPK14RAB9APOLBLMNANPC1
SCHEMBL4335356 0.90 MAPK14 (0.63) MAPK14RAB9APOLB
SCHEMBL4335400 0.90 MAPK14 (0.63) MAPK14RAB9APOLBSMN1; SMN2
SCHEMBL4329197 0.89 MAPK14 (0.78) MAPK14RAB9APOLBLMNANPC1
SCHEMBL4335671 0.88 MAPK14 (0.66) MAPK14RAB9ALMNACYP11B1CYP11B2
SCHEMBL4337503 0.88 MAPK14 (0.70) MAPK14LMNA
SCHEMBL1881818 0.88 MAPK14 (0.70) MAPK14RAB9APOLBLMNANPC1

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
EP-2036905-B1 PYRIDYLISOXAZOLE DERIVATIVE ASKA PHARM CO LTD (JP) 2012-12-12 EP disclosed
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
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 43/4885RAB9A 2267/4885POLB 3172/4885

“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.