SCHEMBL2993414

SCHEMBL2993414

CC(C)(C)C1N(C(=O)O)CCC1(O)Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
GRIN2B Q13224 2/20 0.38
OPRL1 P41146 3/20 0.37
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
OPRM1 P35372 2/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
CYP3A4 P08684 1/20 0.36
ALDH1A1 P00352 1/20 0.36
AVPR1A P37288 1/20 0.36
CHRM4 P08173 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL23256330 0.77 GRIN2B (0.40) GRIN2BMEN1KMT2AALDH1A1
SCHEMBL4136436 0.76 CYP2D6 (0.50) LMNAOPRL1KMT2ACYP3A4ALDH1A1
SCHEMBL23203521 0.73 ALDH1A1 (0.39) LMNAMEN1KMT2AALDH1A1
SCHEMBL2998322 0.71 HSD11B1 (0.31) GRIN2BALDH1A1
SCHEMBL28641817 0.71 CTSB (0.42) MEN1MAPTKMT2ACYP3A4ALDH1A1
SCHEMBL25286794 0.71
SCHEMBL4874228 0.71
SCHEMBL2390990 0.70 CYP3A4 (0.39) LMNAOPRL1MEN1MAPTKMT2A
SCHEMBL23458987 0.69 ALDH1A1 (0.42) LMNAMEN1KMT2ACYP3A4ALDH1A1
SCHEMBL23458984 0.69 ALDH1A1 (0.42) LMNAMEN1KMT2ACYP3A4ALDH1A1

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-20100184805-A1 RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. 2010-07-22 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-20100184805-A1 RENIN INHIBITORS ACE, REN, ACE2 LMNA 3624/4885GRIN2B 1490/4885OPRL1 1448/4885

“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.