SCHEMBL25529288

SCHEMBL25529288

CCc1c(C(=O)O)c(=O)c(-c2ccco2)c(C)n1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.41
TDP1 Q9NUW8 3/20 0.41
POLB P06746 3/20 0.39
CTDSP1 Q9GZU7 2/20 0.39
ALDH1A1 P00352 7/20 0.37
RAB9A P51151 1/20 0.37
PKM P14618 2/20 0.35
ADORA2B P29275 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HSF1 Q00613 1/20 0.35
HSD17B10 Q99714 3/20 0.34
TSHR P16473 2/20 0.34
ALOX5 P09917 1/20 0.34
PTGS1 P23219 1/20 0.34
USP2 O75604 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
CDC25A P30304 1/20 0.34
CDC25B P30305 1/20 0.34
RECQL P46063 2/20 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
SCHEMBL30174175 0.89 L3MBTL1 (0.41) L3MBTL1TDP1POLBCTDSP1ALDH1A1
SCHEMBL25529106 0.87 L3MBTL1 (0.44) L3MBTL1TDP1POLBCTDSP1ALDH1A1
SCHEMBL30174300 0.76 L3MBTL1 (0.39) L3MBTL1TDP1POLBCTDSP1ALDH1A1
SCHEMBL1127114 0.73 L3MBTL1 (0.44) L3MBTL1TDP1POLBCTDSP1ALDH1A1
SCHEMBL10462317 0.72 MAP3K14 (0.40) POLBMEN1KMT2A
SCHEMBL25529268 0.69 USP2 (0.34) L3MBTL1TSHRUSP2MAPTMEN1
SCHEMBL25529258 0.69 L3MBTL1 (0.36) L3MBTL1TDP1POLBCTDSP1ALDH1A1
SCHEMBL10460355 0.66 TSHR (0.47) L3MBTL1TDP1POLBALDH1A1RAB9A
SCHEMBL23488197 0.66 L3MBTL1 (0.61) L3MBTL1TDP1POLBALDH1A1RAB9A
SCHEMBL15162320 0.66 HSP90AA1 (0.47) L3MBTL1TDP1POLBCTDSP1ALDH1A1

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-20230151003-A1 COMPOUNDS AND METHODS OF USE EXELIXIS INC (US) 2023-05-18 US disclosed
US-20230151003-A1 COMPOUNDS AND METHODS OF USE EXELIXIS INC (US) 2023-05-18 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-20230151003-A1 COMPOUNDS AND METHODS OF USE PRKACB, PRKACA, PRKX L3MBTL1 3091/4885TDP1 612/4885POLB 1012/4885

“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.