SCHEMBL3744142

SCHEMBL3744142

CC(C)Cc1cc(C(=O)O)n(CCc2ccc(S(C)(=O)=O)cc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 1/20 0.38
KCNH2 Q12809 1/20 0.38
CCR2 P41597 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
CA9 Q16790 1/20 0.36
ALDH1A1 P00352 3/20 0.36
RORC P51449 3/20 0.35
MCL1 Q07820 1/20 0.35
CXCR1 P25024 2/20 0.34
CXCR2 P25025 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GRN P28799 1/20 0.34

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
SCHEMBL2660919 0.88 CCR2 (0.42) CCR2ALDH1A1CXCR1CXCR2MEN1
SCHEMBL3753063 0.78 GCK (0.49) KCNH2LMNAHPGDSMN1; SMN2
SCHEMBL2662341 0.77 CNR1 (0.41) ALDH1A1MCL1HPGD
SCHEMBL2661360 0.74 HTR2A (0.38) ALDH1A1MEN1KMT2A
SCHEMBL3748911 0.73 HTR2A (0.40) KCNH2ALDH1A1HPGD
SCHEMBL2660918 0.72 PTGS2 (0.45) CCR2MCL1CXCR1CXCR2LMNA
SCHEMBL27776338 0.72 CCR2 (0.43) CCR2LMNA
SCHEMBL2661840 0.71 NOTUM (0.43) CCR2LMNAGRNSORT1
SCHEMBL2662441 0.71 CA12 (0.40) CA12CA1CA2CA9CXCR1
SCHEMBL2662553 0.71 ALDH1A1 (0.59) CA12CA1CA2CA4CA9

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-8299115-B2 Pyrrole-2-carboxamide derivatives as glucokinase activators, their process and pharmaceutical application ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) 2012-10-30 US disclosed
US-20100292143-A1 PYRROLE-2-CARBOXAMIDE DERIVATIVES AS GLUCOKINASE ACTIVATORS, THEIR PROCESS AND PHARMACEUTICAL APPLICATION ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) 2010-11-18 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-20100292143-A1 PYRROLE-2-CARBOXAMIDE DERIVATIVES AS GLUCOKINASE ACTIVATORS, THEIR PROCESS AND PHARMACEUTICAL APPLICATION GCK, PCK1, GCKR KCNJ1 961/4885KCNH2 1962/4885CCR2 2909/4885

“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.