SCHEMBL3973832

SCHEMBL3973832

CC#Cc1cc(Nc2nc(C)ccc2C(=O)O)n(-c2cc(C)ccc2C)n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
SORT1 Q99523 1/20 0.34
LMNA P02545 3/20 0.32
MAPT P10636 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
WNT3A P56704 1/20 0.32
HTT P42858 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CLCN2 P51788 1/20 0.32
CDK4 P11802 1/20 0.31
CCND1 P24385 1/20 0.31
MAPK13 O15264 1/20 0.31
MAPK12 P53778 1/20 0.31
MAPK11 Q15759 1/20 0.31
MAPK14 Q16539 1/20 0.31
PRMT5 O14744 1/20 0.31

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
SCHEMBL13760071 0.87 SMN1; SMN2 (0.45) ACLYSMN1; SMN2SORT1LMNAMAPT
SCHEMBL3883353 0.83 MAPK14 (0.48) ACLYMAPK13MAPK12MAPK11MAPK14
SCHEMBL3863281 0.81 MAPT (0.44) SMN1; SMN2LMNAMAPTMEN1KMT2A
SCHEMBL3979001 0.79 MAPT (0.39) SMN1; SMN2LMNAMAPTMEN1KMT2A
SCHEMBL3974140 0.75 MAPK14 (0.46) MAPK13MAPK12MAPK11MAPK14
SCHEMBL3976330 0.74 MAPK14 (0.46) ACLYMAPK13MAPK12MAPK11MAPK14
SCHEMBL3975282 0.73 MAPK14 (0.42) ACLYMAPK13MAPK12MAPK11MAPK14
SCHEMBL3980494 0.73 MAPK14 (0.59) SORT1LMNAMAPTHTTL3MBTL1
SCHEMBL4251798 0.72 MAPT (0.41) ACLYSMN1; SMN2LMNAMAPTNPC1
SCHEMBL4260404 0.72 ACLY (0.35) ACLYSMN1; SMN2SORT1MEN1KMT2A

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 5 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-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 ACLY 630/4885SMN1; SMN2 4413/4885SORT1 4718/4885
US-20090209451-A1 HETEROARYLAMINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES GPR119, GOT2, IAPP ACLY 630/4885SMN1; SMN2 4413/4885SORT1 4718/4885

“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.