SCHEMBL15630697

SCHEMBL15630697

CCOC(=O)C1CCN(C[C@H](C)c2ccccc2)CC1

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.70
KDM4E B2RXH2 3/20 0.64
HPGD P15428 3/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
NPC1 O15118 1/20 0.60
TSHR P16473 1/20 0.60
RAB9A P51151 1/20 0.60
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
CCR8 P51685 1/20 0.54
PKM P14618 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL1461559 0.87 ALDH1A1 (0.64) ALDH1A1KDM4EMEN1KMT2ACCR8
SCHEMBL15630725 0.86 ALDH1A1 (0.81) ALDH1A1KDM4EHPGDSMN1; SMN2NPC1
SCHEMBL15609794 0.86 KDM4E (0.61) ALDH1A1KDM4EMEN1KMT2ACCR8
SCHEMBL15609795 0.86 KDM4E (0.61) ALDH1A1KDM4EMEN1KMT2ACCR8
SCHEMBL13961307 0.82 ALDH1A1 (0.64) ALDH1A1KDM4EHPGDSMN1; SMN2MEN1
SCHEMBL1506043 0.82 ALDH1A1 (0.66) ALDH1A1KDM4EHPGDSMN1; SMN2NPC1
SCHEMBL11996566 0.80 KDM4E (0.55) ALDH1A1KDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL8473671 0.80 KDM4E (0.67) ALDH1A1KDM4EHPGDSMN1; SMN2NPC1
SCHEMBL15383657 0.80 ALDH1A1 (0.63) ALDH1A1KDM4EHPGDSMN1; SMN2NPC1
SCHEMBL16671210 0.79 KMT2A (0.68) ALDH1A1KDM4EHPGDKMT2A

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-9447090-B2 Imidazopyridine compounds ASTELLAS PHARMA INC. (JP) 2016-09-20 US disclosed
US-20140088080-A1 IMIDAZOPYRIDINE COMPOUNDS ASTELLAS PHARMA INC. (JP) 2014-03-27 US 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-20140088080-A1 IMIDAZOPYRIDINE COMPOUNDS GUCY1A1, PDE2A, GUCY1A2 ALDH1A1 935/4885KDM4E 965/4885HPGD 322/4885

“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.