SCHEMBL3978596

SCHEMBL3978596

Cc1ccc(F)cc1-n1nc(C(C)(C)C)cc1Nc1ncccc1C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.49
SMN1; SMN2 Q16637 4/20 0.47
RAB9A P51151 3/20 0.47
MAPT P10636 3/20 0.47
NPC1 O15118 2/20 0.47
AHR P35869 1/20 0.47
MAPK14 Q16539 10/20 0.45
MAPK13 O15264 7/20 0.45
MAPK12 P53778 7/20 0.45
MAPK11 Q15759 7/20 0.45
ALDH1A1 P00352 2/20 0.44
HPGD P15428 1/20 0.44
HTT P42858 1/20 0.43
MAP4K2 Q12851 1/20 0.40
CDK8 P49336 1/20 0.40
BRAF P15056 1/20 0.39

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
SCHEMBL3864506 0.92 MAPK14 (0.48) LMNARAB9AMAPTNPC1MAPK14
SCHEMBL3974247 0.91 RAB9A (0.52) LMNASMN1; SMN2RAB9AMAPTNPC1
SCHEMBL3980152 0.88 MAPK14 (0.56) LMNASMN1; SMN2RAB9AMAPTNPC1
SCHEMBL3974452 0.86 LMNA (0.48) LMNASMN1; SMN2RAB9AMAPTNPC1
SCHEMBL3976174 0.85 MAPK14 (0.44) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL3860938 0.83 LMNA (0.44) LMNARAB9AMAPTNPC1MAPK14
SCHEMBL3979286 0.83 LMNA (0.51) LMNARAB9AMAPTNPC1MAPK14
SCHEMBL3979999 0.82 RAB9A (0.47) LMNASMN1; SMN2RAB9AMAPTNPC1
SCHEMBL3975283 0.82 MAPK14 (0.48) MAPK14MAPK13MAPK12MAPK11
SCHEMBL3974469 0.82 MAPK14 (0.46) LMNASMN1; SMN2RAB9AMAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090209451-A1 HETEROARYLAMINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES BAYER PHARMACEUTICALS CORPORATION (US) 2009-08-20 US disclosed
US-20090209451-A1 HETEROARYLAMINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES BAYER PHARMACEUTICALS CORPORATION (US) 2009-08-20 US disclosed
US-20090209451-A1 HETEROARYLAMINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES BAYER PHARMACEUTICALS CORPORATION (US) 2009-08-20 US disclosed
US-7517878-B2 Heteroarylaminopyrazole derivatives useful for the treatment of diabetes BAYER PHARAMCEUTICALS CORPORATION (US) 2009-04-14 US disclosed
US-7517878-B2 Heteroarylaminopyrazole derivatives useful for the treatment of diabetes BAYER PHARAMCEUTICALS CORPORATION (US) 2009-04-14 US disclosed
US-7517878-B2 Heteroarylaminopyrazole derivatives useful for the treatment of diabetes BAYER PHARAMCEUTICALS CORPORATION (US) 2009-04-14 US disclosed
US-20050192294-A1 Heteroarylaminopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2005-09-01 US 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 (2 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-20050192294-A1 Heteroarylaminopyrazole derivatives useful for the treatment of diabetes GPR119, GOT2, IAPP LMNA 3423/4885SMN1; SMN2 4413/4885RAB9A 2873/4885
US-20090209451-A1 HETEROARYLAMINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES GPR119, GOT2, IAPP LMNA 3423/4885SMN1; SMN2 4413/4885RAB9A 2873/4885

“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.