SCHEMBL6311550

SCHEMBL6311550

CCc1c(-c2ccccc2)c(C#N)c2nc3ccccn3c2c1Cl

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.48
PIK3CD O00329 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
ADORA1 P30542 4/20 0.38
LMNA P02545 2/20 0.37
GRIA2 P42262 1/20 0.36
GRIA4 P48058 1/20 0.36
ADORA2A P29274 3/20 0.36
ADRA2A P08913 1/20 0.36
HTT P42858 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
MDM2 Q00987 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ADRA1B P35368 1/20 0.34

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
SCHEMBL6310328 0.85 NPSR1 (0.44) KDM4ENPC1RAB9ALMNAHTT
SCHEMBL6310367 0.83 HTT (0.43) KDM4EPIK3CDNPC1RAB9ALMNA
SCHEMBL6311004 0.78 ENPP2 (0.43) KDM4ENPC1RAB9AADORA1LMNA
SCHEMBL6312086 0.78 MAPT (0.47) KDM4ENPC1RAB9ALMNAHTT
SCHEMBL6311562 0.76 HPGD (0.43) KDM4ENPC1RAB9ALMNAHTT
SCHEMBL6310742 0.76 HPGD (0.43) KDM4ENPC1RAB9ALMNAHTT
SCHEMBL6312786 0.76 KDM4E (0.44) KDM4ENPC1RAB9ALMNAHTT
SCHEMBL6311601 0.75 ALDH1A1 (0.41) KDM4EALDH1A1MAPTSMN1; SMN2NPSR1
SCHEMBL6309849 0.73 KDM4E (0.41) KDM4ENPC1RAB9AHSD17B10ALDH1A1
SCHEMBL6318124 0.73 ALDH1A1 (0.43) KDM4ERAB9ALMNAHSD17B10ALDH1A1

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 KDM4E 3360/4885PIK3CD 2813/4885NPC1 901/4885

“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.