SCHEMBL12651563

SCHEMBL12651563

CC(=O)c1c(-c2cccc(N=O)c2)nc2ccccn12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ ALDH1A1 P00352 5/20 0.47
▸ NPC1 O15118 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ MARK4 Q96L34 4/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ NTRK1 P04629 1/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ PKM P14618 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.41
▸ CGAS Q8N884 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ TUBB4A P04350 1/20 0.40
▸ TUBB P07437 1/20 0.40

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
SCHEMBL13312213 0.83 CYP1A2 (0.67) KMT2ASMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL12651564 0.82 TUBB4A (0.46) KMT2ASMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL1786995 0.82 KMT2A (0.55) KMT2ASMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL12651562 0.80 NPC1 (0.43) KMT2ASMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL1791855 0.79 ALDH1A1 (0.67) KMT2ASMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL21712552 0.76 ALDH1A1 (0.67) KMT2ASMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL6409798 0.71 CYP1A2 (0.66) KMT2ASMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL20579818 0.70 CYP1A2 (0.54) KMT2ASMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL8310543 0.70 CYP1A2 (0.56) KMT2ASMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL196599 0.70 KMT2A (1.00) KMT2ASMN1; SMN2ALDH1A1NPC1RAB9A

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-20110124632-A1 IMIDAZOPYRIDINES AS A NOVEL SCAFFOLD FOR MULTI-TARGETED KINASE INHIBITION ABBOTT LABORATORIES (US) 2011-05-26 — — 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-20110124632-A1 IMIDAZOPYRIDINES AS A NOVEL SCAFFOLD FOR MULTI-TARGETED KINASE INHIBITION PACSIN2, MAP4K2, MAP3K6 KMT2A 2567/4885SMN1; SMN2 2442/4885CYP1A2 4754/4885

“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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