SCHEMBL25916155

SCHEMBL25916155

CCCCCC(=O)c1c(O)nc(C)c(C)c1O

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 2/20 0.63
PLA2G5 P39877 2/20 0.63
FFAR1 O14842 1/20 0.49
ALDH1A1 P00352 2/20 0.45
MAPT P10636 2/20 0.45
HTT P42858 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
ATM Q13315 1/20 0.45
FASN P49327 1/20 0.41
ELANE P08246 2/20 0.41
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B3 P37058 2/20 0.40
PAK1 Q13153 1/20 0.40
PTGES O14684 1/20 0.40

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
SCHEMBL9752745 0.79 PLA2G2A (0.96) PLA2G2APLA2G5FFAR1ALDH1A1MAPT
SCHEMBL9752630 0.78 PLA2G2A (1.00) PLA2G2APLA2G5FFAR1ALDH1A1MAPT
SCHEMBL9752639 0.78 PLA2G2A (1.00) PLA2G2APLA2G5FFAR1ALDH1A1MAPT
SCHEMBL9752731 0.78 PLA2G2A (1.00) PLA2G2APLA2G5FFAR1ALDH1A1MAPT
SCHEMBL9752640 0.73 PLA2G2A (0.85) PLA2G2APLA2G5FFAR1ALDH1A1MAPT
SCHEMBL21523095 0.73 PLA2G2A (0.45) PLA2G2APLA2G5FFAR1ALDH1A1MAPT
SCHEMBL31691183 0.73 PLA2G2A (0.45) PLA2G2APLA2G5FFAR1ALDH1A1MAPT
SCHEMBL23151040 0.72 PLA2G2A (0.48) PLA2G2APLA2G5FFAR1ALDH1A1MAPT
SCHEMBL21552582 0.72 PLA2G2A (0.48) PLA2G2APLA2G5FFAR1ALDH1A1MAPT
SCHEMBL21552430 0.72 PLA2G2A (0.48) PLA2G2APLA2G5FFAR1ALDH1A1MAPT

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-20230219912-A1 HALOGENATED BENZOTHIADIAZINES FOR THE TREATMENT OF CANCER NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-07-13 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-20230219912-A1 HALOGENATED BENZOTHIADIAZINES FOR THE TREATMENT OF CANCER TFAM, NDUFAF1, NDUFV1 PLA2G2A 3659/4885PLA2G5 3070/4885FFAR1 2557/4885

“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.