SCHEMBL6538457

SCHEMBL6538457

COC(=O)c1cc(-c2ccc(=O)n(C(C)C)n2)c(-c2ccccc2)nc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
POLB P06746 1/20 0.41
GABRA1 P14867 2/20 0.40
GABRG2 P18507 2/20 0.40
GABRB3 P28472 2/20 0.40
GABRA3 P34903 2/20 0.40
PDCD1 Q15116 1/20 0.39
CD274 Q9NZQ7 1/20 0.39
TP53 P04637 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 2/20 0.38
HPGD P15428 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 1/20 0.38
PDE1A P54750 1/20 0.38
PDE1B Q01064 1/20 0.38
PDE1C Q14123 1/20 0.38
LMNA P02545 1/20 0.37
NPC1 O15118 3/20 0.37

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
SCHEMBL6538296 0.90 ADORA3 (0.44) MAPTPOLBTP53MEN1KMT2A
SCHEMBL6539045 0.89 ALDH1A1 (0.44) MAPTPOLBTP53KMT2AKDM4E
SCHEMBL6538930 0.89 POLB (0.42) MAPTPOLBGABRA1GABRG2GABRB3
SCHEMBL6538824 0.88 MEN1 (0.39) MAPTPOLBGABRA1GABRG2GABRB3
SCHEMBL6538650 0.87 MAPT (0.39) MAPTPOLBGABRA1GABRG2GABRB3
SCHEMBL6538316 0.87 TP53 (0.39) MAPTPOLBGABRA1GABRG2GABRB3
SCHEMBL6538327 0.86 MAPT (0.38) MAPTPOLBGABRA1GABRG2GABRB3
SCHEMBL6538780 0.86 MEN1 (0.37) MAPTPOLBGABRA1GABRG2GABRB3
SCHEMBL6539265 0.84 MEN1 (0.40) MAPTPOLBGABRA1GABRG2GABRB3
SCHEMBL21904912 0.83 POLB (0.46) MAPTPOLBTP53KDM4EALDH1A1

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-20040067955-A1 Pyridazinone compound and pharmaceutical use thereof FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2004-04-08 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-20040067955-A1 Pyridazinone compound and pharmaceutical use thereof ADORA1, ADORA2A, P2RX5 MAPT 629/4885POLB 2406/4885GABRA1 2099/4885

“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.