SCHEMBL2289469

SCHEMBL2289469

Cc1cccc(C)c1Nc1cn2ccccc2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.44
▸ SMN1; SMN2 Q16637 4/20 0.44
▸ GAA P10253 3/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ HTT P42858 2/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ TP53 P04637 3/20 0.43
▸ KDM4E B2RXH2 7/20 0.42
▸ PTGS1 P23219 1/20 0.41
▸ PTGS2 P35354 1/20 0.41
▸ NPC1 O15118 7/20 0.40
▸ RAB9A P51151 7/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ HPGD P15428 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ PKM P14618 2/20 0.39
▸ EPHX2 P34913 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
SCHEMBL2285933 0.90 NPC1 (0.45) MAPTSMN1; SMN2GAAMAPK1TP53
SCHEMBL2291938 0.88 MAPT (0.38) MAPTSMN1; SMN2GAAMAPK1KMT2A
SCHEMBL17962528 0.83 PTGS1 (0.50) MAPTSMN1; SMN2GAAKMT2AHTT
SCHEMBL2295454 0.79 MAP3K5 (0.45) MAPTSMN1; SMN2GAATP53
SCHEMBL1495230 0.77 RAB9A (0.53) MAPTSMN1; SMN2MAPK1KMT2ANPSR1
SCHEMBL758877 0.76 PTGS1 (0.47) MAPTSMN1; SMN2GAAMAPK1KMT2A
SCHEMBL2291165 0.74 MAPT (0.41) MAPTSMN1; SMN2GAAMAPK1KMT2A
SCHEMBL750741 0.73 RAB9A (0.36) MAPTSMN1; SMN2KMT2AHTTL3MBTL1
SCHEMBL11989037 0.72 PTGS1 (0.44) MAPTSMN1; SMN2TP53KDM4EPTGS1
SCHEMBL913680 0.71 PTGS1 (0.58) MAPTSMN1; SMN2MAPK1KDM4EPTGS1

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-8258151-B2 3-aminoimidazo [1,2-A] pyridine derivatives as SGLT inhibitors MERCK PATENT GMBH (DE) 2012-09-04 — — US disclosed
US-20110195991-A1 3-AMINOIMIDAZO [1,2-A] PYRIDINE DERIVATIVES AS SGLT INHIBITORS MERCK PATENT GESELLSCHAFT (DE) 2011-08-11 — — 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-20110195991-A1 3-AMINOIMIDAZO [1,2-A] PYRIDINE DERIVATIVES AS SGLT INHIBITORS GLP1R, SLC5A1, SLC5A2 MAPT 1138/4885SMN1; SMN2 3644/4885GAA 1202/4885

“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.

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