SCHEMBL6310953

SCHEMBL6310953

CCc1c(C)c(C#N)c2nc3ccccc3n2c1C1=CC(N)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 6/20 0.60
MAPT P10636 3/20 0.60
LMNA P02545 3/20 0.60
RAB9A P51151 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
NPC1 O15118 1/20 0.60
MDM2 Q00987 1/20 0.60
KMT2A Q03164 7/20 0.58
MEN1 O00255 6/20 0.58
HK1 P19367 1/20 0.58
HKDC1 Q2TB90 1/20 0.58
TSHR P16473 1/20 0.58
SLC2A1 P11166 1/20 0.53
ALDH1A1 P00352 6/20 0.52
HPGD P15428 1/20 0.52
HTT P42858 1/20 0.52
KDM4E B2RXH2 3/20 0.52
POLB P06746 1/20 0.52
HSP90AA1 P07900 1/20 0.51
GAA P10253 2/20 0.50

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
SCHEMBL6313776 0.79 KMT2A (0.49) NPSR1MAPTLMNARAB9ASMN1; SMN2
SCHEMBL6311670 0.77 NPSR1 (0.61) NPSR1MAPTLMNARAB9ASMN1; SMN2
SCHEMBL6311675 0.76 CYP2C9 (0.63) NPSR1MAPTLMNARAB9ASMN1; SMN2
SCHEMBL6310321 0.75 NPSR1 (1.00) NPSR1MAPTLMNARAB9ASMN1; SMN2
SCHEMBL14478784 0.73 KMT2A (0.70) NPSR1MAPTLMNARAB9ASMN1; SMN2
SCHEMBL6317928 0.69 TSHR (0.61) NPSR1MAPTLMNARAB9ASMN1; SMN2
SCHEMBL14728220 0.69 NPSR1 (0.61) NPSR1MAPTLMNARAB9ASMN1; SMN2
SCHEMBL6310959 0.69 KDM4E (0.35) NPSR1MAPTLMNARAB9ASMN1; SMN2
SCHEMBL6312080 0.68 NPSR1 (1.00) NPSR1MAPTLMNARAB9ASMN1; SMN2
SCHEMBL14478948 0.68 MEN1 (1.00) NPSR1MAPTLMNARAB9ASMN1; 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 NPSR1 1531/4885MAPT 1694/4885LMNA 3993/4885

“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.