SCHEMBL4870567

SCHEMBL4870567

COc1ccc(-c2ccc3cc(-c4c(-c5ccccc5)c5sc(C(=O)O)cc5n4CC(=O)NCCN4CCOCC4)ccc3n2)cc1F

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 1/20 0.45
ALDH1A1 P00352 7/20 0.42
HPGD P15428 6/20 0.42
KDM4E B2RXH2 6/20 0.42
HSD17B10 Q99714 4/20 0.42
POLB P06746 1/20 0.42
ABL1 P00519 2/20 0.41
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPC1 O15118 2/20 0.38
MOK Q9UQ07 1/20 0.38
PDE5A O76074 1/20 0.37
AVPR1B P47901 1/20 0.37
GLA P06280 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
MAPK1 P28482 1/20 0.36

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
SCHEMBL4878882 0.90 ALDH1A1 (0.44) CD274ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL4867756 0.89 ALDH1A1 (0.45) ALDH1A1HPGDKDM4EHSD17B10POLB
SCHEMBL4877125 0.89 ALDH1A1 (0.45) ALDH1A1HPGDKDM4EHSD17B10POLB
SCHEMBL4870548 0.89 CD274 (0.43) CD274ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL4874969 0.89 ALDH1A1 (0.43) ALDH1A1HPGDKDM4EHSD17B10POLB
SCHEMBL4876084 0.85 ALDH1A1 (0.43) ALDH1A1HPGDKDM4EHSD17B10POLB
SCHEMBL4877272 0.84 ALDH1A1 (0.43) ALDH1A1HPGDKDM4EHSD17B10POLB
SCHEMBL4874635 0.84 ALDH1A1 (0.43) ALDH1A1HPGDKDM4EHSD17B10POLB
SCHEMBL14305260 0.83 HTT (0.36) CD274ALDH1A1HPGDABL1PDE5A
SCHEMBL4877164 0.81 AVPR1B (0.44) ALDH1A1HPGDKDM4EHSD17B10POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 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-20080051384-A1 ANTIVIRAL AGENTS EIF2AK2, MAVS, ZC3HAV1 CD274 4210/4885ALDH1A1 1357/4885HPGD 2973/4885

“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.