SCHEMBL6400912

SCHEMBL6400912

CCCn1c(=O)n(N)c(=O)c2ccccc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 3/20 0.64
CNR2 P34972 5/20 0.53
KDM4E B2RXH2 3/20 0.51
GAA P10253 1/20 0.51
RORA P35398 1/20 0.50
RORC P51449 1/20 0.50
RORB Q92753 1/20 0.50
NPC1 O15118 1/20 0.50
ALDH1A1 P00352 4/20 0.48
POLB P06746 3/20 0.48
HPGD P15428 3/20 0.48
LMNA P02545 2/20 0.48
HSD17B10 Q99714 1/20 0.48
USP2 O75604 1/20 0.48
MAPT P10636 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
CASP1 P29466 1/20 0.48
CASP7 P55210 1/20 0.48

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
SCHEMBL12963428 0.79 PGR (0.61) PGRCNR2KDM4EGAARORA
SCHEMBL6407412 0.78 ERCC1 (0.62) PGRKDM4EGAAALDH1A1HPGD
SCHEMBL12963546 0.77 PGR (0.59) PGRCNR2KDM4EGAARORA
SCHEMBL6909258 0.77 PGR (0.57) PGRCNR2KDM4EGAAALDH1A1
SCHEMBL13386557 0.75 ALDH1A1 (0.71) PGRKDM4EGAARORARORC
SCHEMBL30012682 0.74 ALDH1A1 (0.62) PGRCNR2KDM4EGAARORA
SCHEMBL153959 0.74 ALDH1A1 (0.62) PGRCNR2KDM4EGAARORA
SCHEMBL30854944 0.74 ALDH1A1 (0.62) PGRCNR2KDM4EGAARORA
SCHEMBL6417860 0.74 CNR2 (0.68) PGRCNR2KDM4ERORARORC
SCHEMBL29101964 0.73 ALDH1A1 (0.60) PGRCNR2KDM4EGAARORA

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-20050054696-A1 Indole compounds and medicinal use thereof JAPAN TOBACCO INC. (JP) 2005-03-10 US claimed
EP-1452526-A1 INDOLE COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2004-09-01 EP claimed
US-20050054696-A1 Indole compounds and medicinal use thereof JAPAN TOBACCO INC. (JP) 2005-03-10 US disclosed
EP-1452526-A1 INDOLE COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2004-09-01 EP 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-20050054696-A1 Indole compounds and medicinal use thereof IDO1, GPR119, SLC5A1 PGR 3615/4885CNR2 363/4885KDM4E 1617/4885

“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.