SCHEMBL16984085

SCHEMBL16984085

C=CN(/N=C\C)C(=O)n1cncn1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 3/20 0.33
RAB9A P51151 2/20 0.33
MAPT P10636 2/20 0.33
PKM P14618 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.33
MITF O75030 1/20 0.33
HTT P42858 1/20 0.33
GAA P10253 1/20 0.33
ATM Q13315 2/20 0.32
FAAH O00519 1/20 0.32
MGLL Q99685 1/20 0.32
HSP90AA1 P07900 1/20 0.30
HPGD P15428 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL8438655 0.69 LMNA (0.44) LMNAMEN1KMT2AALDH1A1RAB9A
SCHEMBL9368962 0.66 FAAH (0.45) LMNAMEN1KMT2AALDH1A1RAB9A
SCHEMBL28070758 0.64 ALDH1A1 (0.37) LMNAMEN1KMT2AALDH1A1RAB9A
SCHEMBL9427893 0.62
SCHEMBL26822942 0.62 ATM (0.42) LMNAMEN1KMT2AALDH1A1RAB9A
SCHEMBL7268279 0.61 ALDH1A1 (0.43) LMNAMEN1KMT2AALDH1A1RAB9A
SCHEMBL9594434 0.61 ALDH1A1 (0.38) LMNAMEN1KMT2AALDH1A1RAB9A
SCHEMBL28065581 0.61
SCHEMBL10539145 0.61 RAB9A (0.38) LMNAMEN1KMT2AALDH1A1RAB9A
SCHEMBL425384 0.59 LMNA (0.52) LMNAMEN1KMT2AALDH1A1SMN1; 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-9517274-B2 Glycoconjugation processes and compositions PFIZER INC. (US) 2016-12-13 US disclosed
US-20150216996-A1 GLYCOCONJUGATION PROCESSES AND COMPOSITIONS PFIZER INC. 2015-08-06 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-20150216996-A1 GLYCOCONJUGATION PROCESSES AND COMPOSITIONS GNE, SIGLEC7, SIGLEC9 LMNA 4197/4885MEN1 4050/4885KMT2A 3446/4885

“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.