SCHEMBL5010651

SCHEMBL5010651

Cc1cc(Nc2cc(F)ccc2C(=O)O)n(Cc2ccccc2)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.53
KCNJ6 P48051 2/20 0.53
KCNJ5 P48544 2/20 0.53
KCNJ3 P48549 2/20 0.53
KDM4C Q9H3R0 1/20 0.50
MAPT P10636 2/20 0.49
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
CLCN2 P51788 1/20 0.46
GFER P55789 1/20 0.43
P2RY14 Q15391 3/20 0.43
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43

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
SCHEMBL6343810 0.81 GFER (0.52) SMN1; SMN2KCNJ6KCNJ5KCNJ3KDM4C
SCHEMBL5012000 0.80 HTT (0.56) SMN1; SMN2KDM4CMAPTMEN1KMT2A
SCHEMBL6344420 0.78 GFER (0.49) KCNJ6KCNJ5KCNJ3KDM4CMAPT
SCHEMBL6343392 0.76 KMT2A (0.61) SMN1; SMN2MAPTMEN1KMT2ACLCN2
Trifluoroacetic Acid SCHEMBL27617932 0.75 MAPK1 (0.56) SMN1; SMN2KDM4CMAPTMEN1KMT2A
SCHEMBL5465583 0.75 GAA (0.62) MAPTMEN1KMT2ACLCN2GFER
SCHEMBL691573 0.74 MAPK1 (0.50) SMN1; SMN2KDM4CMEN1KMT2ACLCN2
SCHEMBL5178107 0.70 GRN (0.67) SMN1; SMN2KCNJ6KCNJ5KCNJ3MAPT
SCHEMBL848085 0.69 AKR1C3 (0.60) SMN1; SMN2MAPTCLCN2GFER
SCHEMBL22000813 0.69 HDAC3 (0.55) SMN1; SMN2MAPTMEN1KMT2AP2RY14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080064734-A1 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2008-03-13 US disclosed
US-7265144-B2 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2007-09-04 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 (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-20080064734-A1 Anilinopyrazole derivatives useful for the treatment of diabetes IAPP, GLP1R, GPR119 SMN1; SMN2 4113/4885KCNJ6 1526/4885KCNJ5 785/4885

“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.