SCHEMBL26311451

SCHEMBL26311451

CCC(O)COC(=O)C(C1CCCCC1)C1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.41
SHBG P04278 1/20 0.39
ALDH1A1 P00352 2/20 0.38
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
ADRB3 P13945 1/20 0.38
NPSR1 Q6W5P4 1/20 0.35
TSHR P16473 2/20 0.35
THRB P10828 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TP53 P04637 1/20 0.33

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
SCHEMBL6893065 0.76 EPHX1 (0.48) EPHX1SHBGALDH1A1NPSR1TSHR
SCHEMBL12774684 0.75 ADRB2 (0.46) ALDH1A1ADRB2ADRB1ADRB3TP53
SCHEMBL26311440 0.73 MAPT (0.48) ALDH1A1ATML3MBTL1
SCHEMBL27436722 0.72 EPHX1 (0.41) EPHX1SHBGALDH1A1ADRB2ADRB1
SCHEMBL3538057 0.71 EPHX1 (0.52) EPHX1ALDH1A1NPSR1TSHRTHRB
SCHEMBL9846853 0.71 EPHX1 (0.52) EPHX1ALDH1A1NPSR1TSHRTHRB
SCHEMBL23604351 0.71 MEN1 (0.46) ALDH1A1ATM
Dipenine SCHEMBL29385249 0.71 CHRM1 (0.44) EPHX1ALDH1A1NPSR1TSHRTHRB
SCHEMBL26311444 0.71 LMNA (0.45) EPHX1TSHRATM
SCHEMBL2256208 0.71 ALDH1A1 (0.53) SHBGALDH1A1NPSR1TSHRTHRB

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-11720023-B2 Material for forming organic film, method for forming organic film, patterning process, and compound SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-08-08 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-11720023-B2 Material for forming organic film, method for forming organic film, patterning process, and compound CDH1, VCL, OR10J3 EPHX1 344/4885SHBG 3502/4885ALDH1A1 1348/4885

“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.