SCHEMBL8229217

SCHEMBL8229217

IOCCN1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.48
PSMB1 P20618 6/20 0.42
PSMB5 P28074 6/20 0.42
PSMB2 P49721 5/20 0.42
NPC1 O15118 1/20 0.41
TSHR P16473 1/20 0.40
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
LTA4H P09960 1/20 0.38

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
Methylamine SCHEMBL1583273 0.93 HRH3 (0.42) HRH3PSMB1PSMB5PSMB2ALDH1A1
SCHEMBL14041546 0.85 HRH3 (0.56) HRH3
SCHEMBL14553250 0.83 HRH3 (0.61) HRH3L3MBTL1
SCHEMBL8159902 0.82 HRH3 (0.52) HRH3ALDH1A1
SCHEMBL22310345 0.80 HRH3 (0.56) HRH3ALDH1A1MAPTL3MBTL1
Methylamine SCHEMBL1582949 0.80 HRH3 (0.50) HRH3ALDH1A1L3MBTL1
SCHEMBL24059343 0.78 HRH3 (0.60) HRH3PSMB1PSMB5PSMB2NPC1
SCHEMBL8361918 0.78 HRH3 (0.60) HRH3PSMB1PSMB5PSMB2NPC1
SCHEMBL7887990 0.78 HRH3 (0.60) HRH3PSMB1PSMB5PSMB2NPC1
SCHEMBL21386592 0.77 ALDH1A1 (0.40) HRH3NPC1ALDH1A1LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021195599-A1 MTORC1 MODULATORS AND USES THEREOF AEOVIAN PHARMACEUTICALS, INC. (US) 2021-09-30 WO disclosed
US-20200038513-A1 MODULATORS OF FAK PROTEOLYSIS AND ASSOCIATED METHODS OF USE YALE UNIVERSITY 2020-02-06 US disclosed
WO-2007118137-A1 BENZAMIDE DERIVATIVES AS INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2007-10-18 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-20200038513-A1 MODULATORS OF FAK PROTEOLYSIS AND ASSOCIATED METHODS OF USE PTK2, CTTN, CRBN HRH3 3687/4885PSMB1 252/4885PSMB5 433/4885

“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.