SCHEMBL4945859

SCHEMBL4945859

CCCCN(CCCC)C(O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
RIPK1 Q13546 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ALDH1A1 P00352 3/20 0.42
ASAH1 Q13510 2/20 0.42
ACER2 Q5QJU3 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
NAAA Q02083 2/20 0.41
AOC3 Q16853 2/20 0.41
KCNH2 Q12809 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
KDM4E B2RXH2 1/20 0.41
DRD2 P14416 1/20 0.41
OPRM1 P35372 1/20 0.41
DRD3 P35462 1/20 0.41
OPRD1 P41143 1/20 0.41
OPRK1 P41145 1/20 0.41
HTR2A P28223 1/20 0.40

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
SCHEMBL4078829 0.80 ALDH1A1 (0.55) LMNAMEN1KMT2AALDH1A1ASAH1
SCHEMBL20815998 0.80 ALDH1A1 (0.55) LMNAMEN1KMT2AALDH1A1ASAH1
SCHEMBL7662827 0.80 ALDH1A1 (0.55) LMNAMEN1KMT2AALDH1A1ASAH1
SCHEMBL13760041 0.80 ALDH1A1 (0.55) LMNAMEN1KMT2AALDH1A1ASAH1
SCHEMBL1184689 0.80 ALDH1A1 (0.55) LMNAMEN1KMT2AALDH1A1ASAH1
SCHEMBL2715573 0.80 ALDH1A1 (0.55) LMNAMEN1KMT2AALDH1A1ASAH1
SCHEMBL9990265 0.80 MEN1 (0.44) MEN1KMT2ANPSR1SIGMAR1KCNH2
SCHEMBL5317697 0.79 LMNA (0.52) LMNARIPK1ALDH1A1SIGMAR1AOC3
Water SCHEMBL29140161 0.78 MEN1 (0.43) MEN1KMT2ANPSR1SIGMAR1KCNH2
Hydrochloric Acid SCHEMBL20266542 0.77 SIGMAR1 (0.46) MEN1KMT2ANPSR1ALDH1A1ASAH1

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-20230127728-A1 MODIFIED GRAPHENE, METHOD OF PRODUCING MODIFIED GRAPHENE, MODIFIED GRAPHENE-RESIN COMPOSITE, MODIFIED GRAPHENE SHEET, AND MODIFIED GRAPHENE DISPERSION CANON KK (JP) 2023-04-27 US disclosed
EP-1390664-A4 MATERIALS, METHODS, AND USES FOR PHOTOCHEMICAL GENERATION OF ACIDS AND/OR RADICAL SPECIES UNIV ARIZONA (US) 2008-01-02 EP disclosed
EP-1390664-A1 MATERIALS, METHODS, AND USES FOR PHOTOCHEMICAL GENERATION OF ACIDS AND/OR RADICAL SPECIES The Arizona Board of Regents (US) 2004-02-25 EP disclosed
WO-2002079691-A1 MATERIALS, METHODS, AND USES FOR PHOTOCHEMICAL GENERATION OF ACIDS AND/OR RADICAL SPECIES THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2002-10-10 WO 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-20230127728-A1 MODIFIED GRAPHENE, METHOD OF PRODUCING MODIFIED GRAPHENE, MODIFIED GRAPHENE-RESIN COMPOSITE, MODIFIED GRAPHENE SHEET, AND MODIFIED GRAPHENE DISPERSION GRIA1, GRIN1, NR3C1 LMNA 1129/4885RIPK1 4024/4885MEN1 2976/4885

“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.