SCHEMBL21346792

SCHEMBL21346792

CCCCCCC(CCCCC)C1(C)CCS(=O)(=O)C1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.35
▸ GRIK1 P39086 2/20 0.33
▸ GRIK2 Q13002 2/20 0.33
▸ GPR84 Q9NQS5 3/20 0.31
▸ FDPS P14324 3/20 0.31
▸ FFAR1 O14842 1/20 0.31
▸ SLC1A2 P43004 1/20 0.30
▸ SLC1A1 P43005 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ LCK P06239 1/20 0.30
▸ PPARD Q03181 1/20 0.30
▸ ZDHHC20 Q5W0Z9 1/20 0.30
▸ ZDHHC2 Q9UIJ5 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
SCHEMBL21346763 0.87 POLB (0.32) POLB
SCHEMBL18733270 0.74 SLC6A4 (0.37) GPR84FDPSFFAR1LMNA
SCHEMBL21770984 0.70 GNAI3 (0.36) LMNA
SCHEMBL19564599 0.70 GNAI3 (0.36) LMNA
SCHEMBL20387047 0.68 GNAI3 (0.33) GPR84FDPSLMNA
SCHEMBL17142033 0.65 LMNA (0.33) GPR84FDPSFFAR1LMNA
SCHEMBL27676709 0.63 SLC6A4 (0.35) GRIK1GRIK2GPR84FDPSFFAR1
SCHEMBL19710805 0.63 GAA (0.37) GPR84FDPSALDH1A1LMNAHPGD
SCHEMBL24140188 0.62 LMNA (0.38) GPR84FDPSLMNAMAPT
SCHEMBL24919990 0.62 LMNA (0.46) GPR84FDPSFFAR1ALDH1A1LMNA

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-10947222-B2 Indole derivatives useful as inhibitors of diacylglyceride O-acyltransferase 2 MERCK SHARP & DOHME CORP. (US) 2021-03-16 — — US disclosed
US-20190276443-A1 INDOLE DERIVATIVES USEFUL AS INHIBITORS OF DIACYLGLYCERIDE O-ACYLTRANSFERASE 2 MERCK SHARP & DOHME CORP. (US) 2019-09-12 — — 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-10947222-B2 Indole derivatives useful as inhibitors of diacylglyceride O-acyltransferase 2 DGAT2, DGAT1, MOGAT2 POLB 4650/4885GRIK1 2348/4885GRIK2 1922/4885
US-20190276443-A1 INDOLE DERIVATIVES USEFUL AS INHIBITORS OF DIACYLGLYCERIDE O-ACYLTRANSFERASE 2 DGAT2, DGAT1, MOGAT2 POLB 4650/4885GRIK1 2348/4885GRIK2 1922/4885

“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.

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