SCHEMBL13159554

SCHEMBL13159554

C=C(C)C(=O)OC(C)(CC)CCOCc1c2ccccc2cc2ccccc12

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.34
TACR1 P25103 1/20 0.32
LMNA P02545 1/20 0.31
PRNP P04156 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30
L3MBTL1 Q9Y468 2/20 0.30
HTR2A P28223 1/20 0.30

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
SCHEMBL13159337 0.87 EPHX1 (0.36) EPHX1TACR1LMNAPRNPRXFP1
SCHEMBL13159596 0.84 MEN1 (0.39) L3MBTL1
SCHEMBL13159411 0.84 EPHX1 (0.34) EPHX1TACR1LMNAPRNPRXFP1
SCHEMBL13159570 0.82 KDM4E (0.41) LMNACYP1A2CYP2C19L3MBTL1
SCHEMBL13159457 0.80 EPHX1 (0.37) EPHX1TACR1LMNAPRNPRXFP1
SCHEMBL13159594 0.80 GPR84 (0.35) CYP1A2CYP2D6CYP2C19L3MBTL1
SCHEMBL8065282 0.78 THRB (0.46) EPHX1CYP1A2CYP2C19L3MBTL1HTR2A
SCHEMBL13159602 0.78 CASR (0.31)
SCHEMBL13159552 0.77 KDM4E (0.41)
SCHEMBL13159583 0.77 KDM4E (0.49)

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-8808960-B2 Compound and chemically amplified positive resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-08-19 US disclosed
US-8808960-B2 Compound and chemically amplified positive resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-08-19 US disclosed
US-20100233628-A1 COMPOUND AND CHEMICALLY AMPLIFIED POSITIVE RESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-16 US disclosed
US-20100233628-A1 COMPOUND AND CHEMICALLY AMPLIFIED POSITIVE RESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-16 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-20100233628-A1 COMPOUND AND CHEMICALLY AMPLIFIED POSITIVE RESIST COMPOSITION HRH3, C9, H1-2 EPHX1 3913/4885TACR1 544/4885LMNA 2222/4885

“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.