SCHEMBL6312322

SCHEMBL6312322

CCCCc1c(C)c(C#N)c2nc3ccc(C(=O)OCC)cc3n2c1Cl

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.64
KMT2A Q03164 4/20 0.64
MAPT P10636 3/20 0.64
NPSR1 Q6W5P4 3/20 0.64
HPGD P15428 3/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
HTT P42858 1/20 0.64
HSP90AA1 P07900 1/20 0.53
LMNA P02545 2/20 0.52
NPC1 O15118 2/20 0.52
MDM2 Q00987 1/20 0.52
PDE2A O00408 2/20 0.47
PDE10A Q9Y233 1/20 0.47
MEN1 O00255 3/20 0.43
ALDH1A1 P00352 4/20 0.43
POLB P06746 2/20 0.43
SLC2A1 P11166 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL6318629 0.93 HPGD (0.64) RAB9AKMT2AMAPTNPSR1HPGD
SCHEMBL6311038 0.79 KMT2A (0.72) RAB9AKMT2AMAPTNPSR1HPGD
SCHEMBL14478838 0.76 KMT2A (0.93) RAB9AKMT2AMAPTNPSR1HPGD
SCHEMBL6311557 0.75 KMT2A (0.91) RAB9AKMT2AMAPTNPSR1HPGD
SCHEMBL6318121 0.74 NPSR1 (0.71) RAB9AKMT2AMAPTNPSR1HPGD
SCHEMBL6311704 0.74 HPGD (0.44) RAB9AKMT2AMAPTNPSR1HPGD
SCHEMBL6311683 0.73 HSP90AA1 (0.72) RAB9AKMT2AMAPTNPSR1HPGD
SCHEMBL6651847 0.73 KDM4E (0.66) RAB9AKMT2AMAPTNPSR1HPGD
SCHEMBL6311707 0.73 HPGD (0.45) RAB9AKMT2AMAPTNPSR1HPGD
SCHEMBL6653657 0.71 KDM4E (0.66) RAB9AKMT2AMAPTNPSR1HPGD

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 RAB9A 2347/4885KMT2A 4210/4885MAPT 1694/4885

“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.