SCHEMBL28700372

SCHEMBL28700372

CCOc1cc(C=O)c(C)c(OCC)c1C1CC1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
POLB P06746 1/20 0.44
ALDH1A1 P00352 11/20 0.39
KDM4E B2RXH2 4/20 0.39
TSHR P16473 3/20 0.33
GAA P10253 3/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
RECQL P46063 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
ERN1 O75460 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL29633551 0.84 LMNA (0.44) LMNAPOLBALDH1A1KDM4ETSHR
SCHEMBL22946085 0.80 TSHR (0.36) LMNAALDH1A1KDM4ETSHRGAA
SCHEMBL29633534 0.76 LMNA (0.58) LMNAPOLBALDH1A1KDM4ETSHR
SCHEMBL22946244 0.76 LMNA (0.58) LMNAPOLBALDH1A1KDM4ETSHR
SCHEMBL2962020 0.75 ALDH1A1 (0.50) LMNAPOLBALDH1A1KDM4EMAPT
SCHEMBL24488926 0.74 POLB (0.35) LMNAPOLBALDH1A1KDM4ERECQL
SCHEMBL18318930 0.74 LMNA (0.47) LMNAPOLBALDH1A1KDM4ETSHR
SCHEMBL16056064 0.72 ALDH1A1 (0.51) LMNAPOLBALDH1A1KDM4ETSHR
SCHEMBL16055280 0.72 SSTR5 (0.40) LMNAPOLBALDH1A1MAPT
SCHEMBL4879750 0.71 LMNA (0.47) LMNAALDH1A1KDM4ETSHRMAPT

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-12338203-B2 Urea compound for antagonizing LPA1 receptor TAISHO PHARMACEUTICAL CO., LTD. (JP) 2025-06-24 US disclosed
CN-119823001-A Urea compounds antagonizing LPA1 receptor 大正制药株式会社 2025-04-15 CN disclosed
CN-114206832-B Urea compounds antagonizing LPA1 receptor 大正制药株式会社 2025-04-04 CN disclosed
CN-114206832-A Urea compounds antagonizing LPA1 receptor 大正制药株式会社 2022-03-18 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-12338203-B2 Urea compound for antagonizing LPA1 receptor LPAR1, LPAR2, LPAR3 LMNA 2200/4885POLB 4112/4885ALDH1A1 1250/4885

“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.