SCHEMBL6310756

SCHEMBL6310756

Cc1c(-c2ccccc2)c(=O)n2c(nc3[nH]cccc32)c1C#N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CYP1A2 P05177 2/20 0.44
PKM P14618 1/20 0.44
TSHR P16473 1/20 0.44
ALDH1A1 P00352 9/20 0.42
KDM4E B2RXH2 5/20 0.42
LMNA P02545 5/20 0.41
NPSR1 Q6W5P4 2/20 0.41
RXFP1 Q9HBX9 2/20 0.41
NCOA3 Q9Y6Q9 1/20 0.41
HK1 P19367 1/20 0.40
HKDC1 Q2TB90 1/20 0.40
CYP2C19 P33261 2/20 0.40
MAPT P10636 4/20 0.39
HTT P42858 3/20 0.39
GAA P10253 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
HPGD P15428 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
SCHEMBL6313209 0.83 KMT2A (0.36) CYP2C9MEN1KMT2ATSHRALDH1A1
SCHEMBL6313706 0.78 ALDH1A1 (0.55) CYP2C9MEN1KMT2ATSHRALDH1A1
SCHEMBL6311981 0.71 KDM4E (0.66) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL6310360 0.68 MAPT (0.67) MEN1KMT2ATSHRALDH1A1KDM4E
SCHEMBL5450233 0.68 CYP1A2 (0.42) CYP2C9MEN1KMT2ACYP1A2PKM
SCHEMBL12243901 0.66 MAPT (0.57) CYP2C9MEN1KMT2ATSHRALDH1A1
SCHEMBL6313411 0.65 LMNA (0.47) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL6317936 0.65 ALDH1A1 (0.55) CYP2C9MEN1KMT2APKMTSHR
SCHEMBL5444663 0.65 CYP1A2 (0.46) CYP2C9MEN1KMT2ACYP1A2PKM
SCHEMBL5444157 0.65 CYP1A2 (0.46) CYP2C9MEN1KMT2ACYP1A2PKM

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-20050113397-A1 Imidazo[1,2-a]pyridine derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-05-26 US disclosed
EP-1479681-A1 IMIDAZO(1,2-a)PYRIDINE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-11-24 EP 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-20050113397-A1 Imidazo[1,2-a]pyridine derivative MANBA, MAN2B1, ERG28 CYP2C9 1066/4885MEN1 2268/4885KMT2A 4210/4885

“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.