SCHEMBL19465600

SCHEMBL19465600

Cc1cc(C(=O)O)nc2c1cnn2-c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CFTR P13569 2/20 0.58
▸ DPP4 P27487 3/20 0.51
▸ GRM1 Q13255 3/20 0.50
▸ KDM4E B2RXH2 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ MAPK14 Q16539 3/20 0.47
▸ GRM2 Q14416 1/20 0.47
▸ HPGD P15428 2/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ GRM5 P41594 1/20 0.46
▸ MAPK11 Q15759 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ ABL1 P00519 1/20 0.46
▸ SRC P12931 1/20 0.46

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
SCHEMBL19465583 0.80 CFTR (0.55) CFTRGRM1KDM4EMAPTMEN1
SCHEMBL19465591 0.75 KDM4E (0.53) CFTRKDM4EMAPTALDH1A1KMT2A
SCHEMBL18692830 0.75 CFTR (1.00) CFTRALDH1A1
SCHEMBL19465578 0.71 KDM4E (0.60) CFTRKDM4EMAPTMEN1ALDH1A1
SCHEMBL6281507 0.71 KDM4E (0.58) DPP4GRM1KDM4EMAPTMEN1
SCHEMBL2377166 0.71 ALDH1A1 (0.73) KDM4EMAPTALDH1A1RAB9AGRM2
SCHEMBL31547886 0.70 GRM1 (0.68) DPP4GRM1NPC1ALDH1A1HPGD
SCHEMBL13343675 0.69 PTGS2 (0.67) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL4300658 0.69 MAPK1 (0.54) MAPTNPC1ALDH1A1RAB9AHPGD
SCHEMBL6287500 0.69 KDM4E (0.59) DPP4GRM1KDM4EMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9796711-B2 Substituted pyrazolo[3,4-b]pyridin-6-carboxylic acids and method of use ABBVIE S.Á.R.L. (LU) 2017-10-24 — — US disclosed
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