SCHEMBL23854655

SCHEMBL23854655

COc1ccc(F)c(C(C)=O)n1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
NNMT P40261 3/20 0.42
CYP1A2 P05177 2/20 0.37
KCNK3 O14649 2/20 0.36
KCNK9 Q9NPC2 2/20 0.36
MTNR1A P48039 4/20 0.36
MTNR1B P49286 4/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
PTGS2 P35354 1/20 0.36
ERN1 O75460 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
ADORA2A P29274 1/20 0.34

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
SCHEMBL14358290 0.85 TDP1 (0.51) POLBTDP1NNMTCYP1A2KCNK3
SCHEMBL25285040 0.81 NNMT (0.35) NNMT
SCHEMBL22040677 0.79 POLB (0.44) POLBTDP1NNMTCYP1A2MTNR1A
SCHEMBL29432823 0.79 NNMT (0.47) POLBTDP1NNMTCYP1A2MTNR1A
SCHEMBL14458102 0.79 POLB (0.44) POLBTDP1NNMTCYP1A2MTNR1A
SCHEMBL21046517 0.78 POLB (0.43) POLBTDP1NNMTCYP1A2KCNK3
SCHEMBL1860901 0.77 POLB (0.40) POLBTDP1NNMTCYP1A2MTNR1A
SCHEMBL30409470 0.77 PTGS2 (0.33) NPC1RAB9APTGS2
SCHEMBL1855234 0.77 PTGS2 (0.33) NPC1RAB9APTGS2
SCHEMBL9649585 0.76 TDP1 (0.64) POLBTDP1NNMTCYP1A2NPC1

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-20210300900-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2021-09-30 US disclosed
CN-112334462-A OGA inhibitor compounds 詹森药业有限公司 2021-02-05 CN 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-20210300900-A1 OGA INHIBITOR COMPOUNDS OGA, OGT, GRN POLB 402/4885TDP1 83/4885NNMT 427/4885

“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.