SCHEMBL25908595

SCHEMBL25908595

CC(C)c1cccc(Oc2ccc(CCI)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CYP2D6 P10635 1/20 0.44
GLI1 P08151 1/20 0.43
GLI2 P10070 1/20 0.43
KDM4E B2RXH2 1/20 0.42
TSHR P16473 1/20 0.42
CASR P41180 1/20 0.41
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MITF O75030 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
GFER P55789 1/20 0.41
NLRP1 Q9C000 1/20 0.41
NOD2 Q9HC29 1/20 0.41
CETP P11597 2/20 0.40
ALOX5 P09917 1/20 0.40
FDFT1 P37268 1/20 0.39

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
SCHEMBL14045230 0.85 FDFT1 (0.47) PTGS1MEN1KMT2ACYP2D6GLI1
SCHEMBL123764 0.85 PTGS1 (0.58) PTGS1MEN1KMT2ACYP2D6KDM4E
SCHEMBL10030557 0.84 KDM4E (0.48) PTGS1MEN1KMT2ACYP2D6GLI1
SCHEMBL506935 0.84 ST14 (0.56) PTGS1MEN1KMT2ACYP2D6KDM4E
SCHEMBL9502718 0.83 PTGS1 (0.46) PTGS1MEN1KMT2ACYP2D6GLI1
SCHEMBL15397423 0.83 LTA4H (0.58) PTGS1MEN1KMT2ACYP2D6GLI1
SCHEMBL8636829 0.81 PTGS1 (0.54) PTGS1MEN1KMT2ACYP2D6KDM4E
SCHEMBL11063307 0.81 PTGS1 (0.56) PTGS1MEN1KMT2ACYP2D6KDM4E
SCHEMBL30345552 0.81 PTGS1 (0.56) PTGS1MEN1KMT2ACYP2D6KDM4E
SCHEMBL30358257 0.79 PTGS1 (0.66) PTGS1MEN1KMT2ACYP2D6KDM4E

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-20230244147-A1 COMPOSITION FOR FORMING ORGANIC FILM, PATTERNING PROCESS, AND COMPOUND AND POLYMER FOR FORMING ORGANIC FILM SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-08-03 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-20230244147-A1 COMPOSITION FOR FORMING ORGANIC FILM, PATTERNING PROCESS, AND COMPOUND AND POLYMER FOR FORMING ORGANIC FILM OR10J3, PYM1, AP1M1 PTGS1 2209/4885MEN1 459/4885KMT2A 715/4885

“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.