SCHEMBL2094520

SCHEMBL2094520

CCCC(N)C(N)c1ccc(-c2ccccc2)cc1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.43
HPGD P15428 2/20 0.40
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 1/20 0.40
USP2 O75604 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
HSP90AA1 P07900 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.40
COMT P21964 1/20 0.39
ACMSD Q8TDX5 3/20 0.38
HNF4A P41235 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 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
SCHEMBL4596009 0.83 ALOX5 (0.50) ALOX5HPGDKDM4EMEN1USP2
SCHEMBL4596274 0.73 ALOX5 (0.50) ALOX5HPGDKDM4EMEN1USP2
SCHEMBL17878569 0.72 ALOX5 (0.57) ALOX5HPGDKDM4EMEN1USP2
SCHEMBL51054 0.72 ALOX5 (0.57) ALOX5HPGDKDM4EMEN1USP2
SCHEMBL1038159 0.71 ALOX5 (0.43) ALOX5HPGDKDM4EMEN1USP2
SCHEMBL6881260 0.70 MGLL (0.42) ALOX5HPGDKDM4EMEN1USP2
SCHEMBL4948052 0.70 ACMSD (0.47) ALOX5HPGDKDM4ELMNAMAPT
SCHEMBL22888664 0.70 ALOX5 (0.46) ALOX5HPGDKDM4EMEN1USP2
SCHEMBL28416425 0.68 DPP4 (0.54) LMNA
SCHEMBL51614 0.67 ALOX5 (0.55) ALOX5HPGDKDM4EMEN1USP2

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-8163953-B2 Compounds for lysosomal modulation and methods of use UNIVERSITY OF CONNECTICUT (US) 2012-04-24 US disclosed
US-20090281178-A1 Compounds for Lysosomal Modulation and Methods of Use UNIVERSITY OF CONNECTICUT 2009-11-12 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-20090281178-A1 Compounds for Lysosomal Modulation and Methods of Use GAA, GBA1, CTSA ALOX5 3047/4885HPGD 2575/4885KDM4E 3955/4885

“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.