SCHEMBL17888367

SCHEMBL17888367

Cc1ccc(C(=O)N2CCN(c3cccnc3)CC2)cc1

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.68
HTT P42858 2/20 0.68
NAMPT P43490 1/20 0.61
LMNA P02545 1/20 0.59
SLC6A7 Q99884 2/20 0.59
KDM4E B2RXH2 1/20 0.59
ALDH1A1 P00352 5/20 0.58
GRM1 Q13255 1/20 0.54
POLB P06746 3/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
PKM P14618 1/20 0.53
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52

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
SCHEMBL95759 0.86 NAMPT (0.61) MAPTHTTNAMPTSLC6A7ALDH1A1
SCHEMBL17886718 0.86 ALDH1A1 (0.59) MAPTHTTNAMPTLMNAKDM4E
SCHEMBL12082812 0.83 LMNA (0.69) MAPTHTTNAMPTLMNASLC6A7
SCHEMBL2377185 0.83 ALDH1A1 (0.57) MAPTHTTNAMPTLMNAALDH1A1
SCHEMBL10721885 0.83 POLB (0.74) MAPTLMNASLC6A7KDM4EALDH1A1
SCHEMBL1433477 0.80 TRPV1 (0.54) MAPTNAMPTALDH1A1
SCHEMBL30663952 0.80 TRPV1 (0.54) MAPTNAMPTALDH1A1
SCHEMBL27781454 0.79 TRPV1 (0.56) NAMPTALDH1A1
SCHEMBL21987023 0.79 MAPT (0.69) MAPTHTTNAMPTLMNASLC6A7
SCHEMBL22495238 0.79 MAPT (0.74) MAPTHTTNAMPTLMNAKDM4E

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-20170226132-A1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-08-10 US disclosed
US-20160185780-A1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2016-06-30 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 (2 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-20160185780-A1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF ABL1, JAK2, JAK1 MAPT 2732/4885HTT 4749/4885NAMPT 1885/4885
US-20170226132-A1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF ABL1, JAK2, JAK1 MAPT 2732/4885HTT 4749/4885NAMPT 1885/4885

“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.