SCHEMBL4119847

SCHEMBL4119847

CC(C)(C)C([NH])C(=O)Nc1nccs1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.56
TSHR P16473 1/20 0.56
HSPA5 P11021 6/20 0.55
HSPA9 P38646 3/20 0.55
FFAR2 O15552 4/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
NR3C1 P04150 1/20 0.51
HSPA2 P54652 1/20 0.50
NPC1 O15118 1/20 0.50
MAPT P10636 1/20 0.50

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
SCHEMBL4119851 0.83 HSPA5 (0.57) LMNATSHRHSPA5HSPA9FFAR2
SCHEMBL12884426 0.83 LMNA (0.58) LMNATSHRHSPA5HSPA9FFAR2
SCHEMBL6056907 0.83 HSPA5 (0.57) LMNATSHRHSPA5HSPA9FFAR2
Hydrochloric Acid SCHEMBL7422746 0.81 HSPA5 (0.56) LMNATSHRHSPA5HSPA9FFAR2
SCHEMBL1107000 0.80 ADORA2A (0.68) LMNATSHRHSPA5HSPA9FFAR2
SCHEMBL7873389 0.78 HSPA5 (0.53) LMNATSHRHSPA5HSPA9FFAR2
SCHEMBL23804604 0.77 LMNA (0.59) LMNATSHRHSPA5HSPA9FFAR2
SCHEMBL7876872 0.77 LMNA (0.59) LMNATSHRHSPA5HSPA9FFAR2
SCHEMBL27891187 0.77 FFAR2 (0.62) LMNATSHRHSPA5HSPA9FFAR2
SCHEMBL592704 0.76 MEN1 (0.65) MEN1KMT2ANR3C1NPC1MAPT

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-8431565-B2 Substituted imidazoheterocycles CARA THERAPEUTICS, INC. (US) 2013-04-30 US claimed
US-20090149450-A1 SUBSTITUTED IMIDAZOHETEROCYCLES CARA THERAPEUTICS, INC. (US) 2009-06-11 US claimed

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-20090149450-A1 SUBSTITUTED IMIDAZOHETEROCYCLES CNR1, CNR2, TRPV1 LMNA 3582/4885TSHR 1095/4885HSPA5 2974/4885

“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.