SCHEMBL18782837

SCHEMBL18782837

CCOC(=O)NC(C)C(=O)C(CC)CC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.40
▸ LMNA P02545 2/20 0.40
▸ HTT P42858 1/20 0.40
▸ ACACB O00763 1/20 0.37
▸ MGAM O43451 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ SI P14410 1/20 0.37
▸ MGAM2 Q2M2H8 1/20 0.37
▸ MAPK1 P28482 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ RAB9A P51151 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ USP2 O75604 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ BIRC2 Q13490 1/20 0.33
▸ METAP2 P50579 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
SCHEMBL13309234 0.84 SMN1; SMN2 (0.41) SMN1; SMN2LMNAHTTACACBMGAM
SCHEMBL890185 0.84 SMN1; SMN2 (0.41) SMN1; SMN2LMNAHTTACACBMGAM
SCHEMBL12175181 0.84 SMN1; SMN2 (0.41) SMN1; SMN2LMNAHTTACACBMGAM
SCHEMBL22751568 0.79 METAP2 (0.46) SMN1; SMN2LMNAHTTMGAMGAA
SCHEMBL11189746 0.79 METAP2 (0.46) SMN1; SMN2LMNAHTTMGAMGAA
SCHEMBL24950429 0.78 TSHR (0.49) SMN1; SMN2LMNAHTTMGAMGAA
SCHEMBL10513380 0.78 TYR (0.44) SMN1; SMN2LMNAHTTACACBMGAM
SCHEMBL12147575 0.78 SMN1; SMN2 (0.42) SMN1; SMN2LMNAHTTACACBMGAM
SCHEMBL12175221 0.78 SMN1; SMN2 (0.42) SMN1; SMN2LMNAHTTACACBMGAM
SCHEMBL3551870 0.78 TYR (0.44) SMN1; SMN2LMNAHTTACACBMGAM

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-10017499-B2 Benzimidazole derivatives ENANTA PHARMACEUTICALS, INC. (US) 2018-07-10 — — US disclosed
US-20170114046-A1 NOVEL BENZIMIDAZOLE DERIVATIVES ENANTA PHARM INC (US) 2017-04-27 — — 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-20170114046-A1 NOVEL BENZIMIDAZOLE DERIVATIVES EIF2AK2, ZC3HAV1, HAVCR2 SMN1; SMN2 3741/4885LMNA 3064/4885HTT 4659/4885
US-10017499-B2 Benzimidazole derivatives EIF2AK2, ZC3HAV1, ZC3HAV1L SMN1; SMN2 3511/4885LMNA 2786/4885HTT 4500/4885

“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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