SCHEMBL24045162

SCHEMBL24045162

CCCCCCCC(C)(CCCCCC)NCCC

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.39
TSHR P16473 2/20 0.38
THRB P10828 1/20 0.38
ALDH1A1 P00352 1/20 0.36
GGPS1 O95749 6/20 0.35
PPARA Q07869 2/20 0.35
ADH1B P00325 1/20 0.34
ADH1C P00326 1/20 0.34
ADH1A P07327 1/20 0.34
ADH4 P08319 1/20 0.34
ADH7 P40394 1/20 0.34
FDPS P14324 9/20 0.34
CES2 O00748 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
SCHEMBL18525926 1.00 EPHX1 (0.39) EPHX1TSHRTHRBALDH1A1GGPS1
SCHEMBL20643823 0.91 EPHX1 (0.44) EPHX1TSHRTHRBALDH1A1GGPS1
SCHEMBL19352948 0.91 EPHX1 (0.39) EPHX1TSHRTHRBALDH1A1GGPS1
SCHEMBL21790405 0.88 EPHX1 (0.42) EPHX1TSHRTHRBALDH1A1GGPS1
SCHEMBL19242564 0.86 TSHR (0.36) EPHX1TSHRTHRBALDH1A1GGPS1
SCHEMBL18482260 0.86 EPHX1 (0.44) EPHX1TSHRTHRBALDH1A1PPARA
SCHEMBL28182999 0.86 EPHX1 (0.44) EPHX1TSHRTHRBALDH1A1PPARA
SCHEMBL20869918 0.85 DNM1 (0.42) EPHX1TSHRTHRBALDH1A1GGPS1
SCHEMBL24091302 0.85 DNM1 (0.42) EPHX1TSHRTHRBALDH1A1GGPS1
SCHEMBL24927622 0.85 EPHX1 (0.50) EPHX1TSHRTHRBALDH1A1GGPS1

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-11787810-B2 Diacylglyceride O-acyltransferase 2 inhibitors MERCK SHARP & DOHME LLC (US) 2023-10-17 US disclosed
US-20210363147-A1 NOVEL DIACYLGLYCERIDE O-ACYLTRANSFERASE 2 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2021-11-25 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 (2 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-11787810-B2 Diacylglyceride O-acyltransferase 2 inhibitors DGAT2, DGAT1, ACAT2 EPHX1 848/4885TSHR 4648/4885THRB 3647/4885
US-20210363147-A1 NOVEL DIACYLGLYCERIDE O-ACYLTRANSFERASE 2 INHIBITORS DGAT2, DGAT1, ACAT2 EPHX1 858/4885TSHR 4632/4885THRB 3626/4885

“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.