SCHEMBL6311792

SCHEMBL6311792

Cc1c(-c2ccccc2)c(N2CC[C@H](NCc3ccccc3)C2)c2c(nc3ccccn32)c1C#N

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.40
ALDH1A1 P00352 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ACHE P22303 7/20 0.37
SUV39H2 Q9H5I1 2/20 0.37
VCP P55072 2/20 0.36
BRD4 O60885 1/20 0.36
BCHE P06276 4/20 0.36
BACE1 P56817 4/20 0.36
RET P07949 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SAE1 Q9UBE0 1/20 0.34
UBA2 Q9UBT2 1/20 0.34
HRH4 Q9H3N8 1/20 0.34
MOGAT2 Q3SYC2 2/20 0.33

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
SCHEMBL6311937 0.81 PIK3CD (0.33) ALDH1A1ACHEKDM4EHPGD
SCHEMBL6319337 0.79 CSNK1E (0.35) ALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL6311653 0.79 HRH3 (0.37)
SCHEMBL6317942 0.78 KMT2A (0.38) ALDH1A1KDM4EHPGD
SCHEMBL6654557 0.77 CHRM4 (0.37) ALDH1A1KDM4EHPGD
SCHEMBL6320019 0.74 HRH4 (0.34) ALDH1A1KDM4EHPGDHRH4
SCHEMBL6319498 0.74 PIK3CD (0.31) KDM4E
SCHEMBL6310382 0.73 CKS1B (0.37)
SCHEMBL6310367 0.73 HTT (0.43) ALDH1A1L3MBTL1KDM4EHPGDSMN1; SMN2
SCHEMBL6311786 0.72 ALDH1A1 (0.47) ALDH1A1KDM4EHPGDSMN1; SMN2

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 AKT1 3238/4885ALDH1A1 2550/4885L3MBTL1 3913/4885

“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.