SCHEMBL17320379

SCHEMBL17320379

CC(=O)/C=C/NCc1ccc(C)cc1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.61
LMNA P02545 5/20 0.61
HPGD P15428 4/20 0.61
GLA P06280 1/20 0.61
SMN1; SMN2 Q16637 5/20 0.60
RAB9A P51151 4/20 0.60
NPC1 O15118 4/20 0.60
MAPT P10636 2/20 0.60
HTT P42858 1/20 0.47
KMT2A Q03164 5/20 0.42
MEN1 O00255 3/20 0.41
TP53 P04637 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
SCHEMBL15905318 1.00 ALDH1A1 (0.61) ALDH1A1LMNAHPGDGLASMN1; SMN2
SCHEMBL15899385 0.84 ALDH1A1 (0.62) ALDH1A1LMNAHPGDGLASMN1; SMN2
SCHEMBL15899383 0.84 ALDH1A1 (0.62) ALDH1A1LMNAHPGDGLASMN1; SMN2
SCHEMBL15903179 0.80 ALDH1A1 (0.51) ALDH1A1LMNAHPGDGLASMN1; SMN2
SCHEMBL17320382 0.80 ALDH1A1 (0.51) ALDH1A1LMNAHPGDGLASMN1; SMN2
SCHEMBL13373265 0.75 ALDH1A1 (0.49) ALDH1A1LMNAHPGDGLASMN1; SMN2
SCHEMBL21284942 0.73 ALDH1A1 (0.47) ALDH1A1LMNAHPGDGLASMN1; SMN2
SCHEMBL31566 0.72 ADH1B (0.61) ALDH1A1LMNAHPGDGLASMN1; SMN2
SCHEMBL15904635 0.72 KMT2A (0.53) ALDH1A1LMNAHPGDSMN1; SMN2RAB9A
SCHEMBL17320381 0.72 KMT2A (0.53) ALDH1A1LMNAHPGDSMN1; SMN2RAB9A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9376387-B2 Oxidisable pyridine derivatives, their preparation and use as anti-alzheimer agents INSA INST NAT DES SCIENCES APPLIQUEES DE ROUEN (FR) 2016-06-28 US disclosed
US-9376387-B2 Oxidisable pyridine derivatives, their preparation and use as anti-alzheimer agents INSA INST NAT DES SCIENCES APPLIQUEES DE ROUEN (FR) 2016-06-28 US disclosed
US-20150353493-A1 OXIDISABLE PYRIDINE DERIVATIVES, THEIR PREPARATION AND USE AS ANTI-ALZHEIMER AGENTS INSA (INSTITUT NATIONAL DES SCIENCES APPLIQUEES DE ROUEN (FR) 2015-12-10 US disclosed
US-20150353493-A1 OXIDISABLE PYRIDINE DERIVATIVES, THEIR PREPARATION AND USE AS ANTI-ALZHEIMER AGENTS INSA (INSTITUT NATIONAL DES SCIENCES APPLIQUEES DE ROUEN (FR) 2015-12-10 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-20150353493-A1 OXIDISABLE PYRIDINE DERIVATIVES, THEIR PREPARATION AND USE AS ANTI-ALZHEIMER AGENTS CBR3, CBR1, CYB5R3 ALDH1A1 3811/4885LMNA 2012/4885HPGD 755/4885

“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.