SCHEMBL7213327

SCHEMBL7213327

CC1(C)CCC(NCc2ccccc2)C1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.57
OPRL1 P41146 2/20 0.57
GRIN2B Q13224 3/20 0.51
ACHE P22303 3/20 0.47
BACE1 P56817 3/20 0.47
BCHE P06276 2/20 0.47
MEN1 O00255 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
CARM1 Q86X55 1/20 0.46
PRMT6 Q96LA8 1/20 0.46
TMEM97 Q5BJF2 1/20 0.45
CCR2 P41597 1/20 0.45
FYN P06241 1/20 0.44

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
SCHEMBL2376300 0.90 OPRM1 (0.51) OPRM1OPRL1GRIN2BACHEBACE1
SCHEMBL26347105 0.90 OPRM1 (0.51) OPRM1OPRL1GRIN2BACHEBACE1
SCHEMBL21744620 0.90 OPRM1 (0.65) OPRM1OPRL1GRIN2BACHEBACE1
Hydrochloric Acid SCHEMBL31629842 0.88 OPRM1 (0.66) OPRM1OPRL1GRIN2BACHEBACE1
SCHEMBL8712547 0.81 OPRM1 (0.55) OPRM1OPRL1GRIN2BACHEBACE1
SCHEMBL2588468 0.80 OPRM1 (0.61) OPRM1OPRL1GRIN2BACHEBACE1
SCHEMBL2379073 0.80 FUCA1 (0.52) OPRM1OPRL1GRIN2BACHEBACE1
SCHEMBL20818826 0.78 OPRM1 (0.49) OPRM1OPRL1GRIN2BACHEBACE1
SCHEMBL20825939 0.78 GRIN2B (0.49) OPRM1OPRL1GRIN2BACHEBACE1
SCHEMBL1644281 0.78 GRIN2B (0.49) OPRM1OPRL1GRIN2BACHEBACE1

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-6624309-B1 Administering 4-heterocyclicbenzamide derivative BRISTOL-MYERS SQUIBB COMPANY 2003-09-23 US disclosed
US-20020137968-A1 Benzoic acid derivatives and related compounds as antiarrhythmic agents LLOYD JOHN (US) 2002-09-26 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-20020137968-A1 Benzoic acid derivatives and related compounds as antiarrhythmic agents SCN1A, SCN1B, NR0B1 OPRM1 384/4885OPRL1 292/4885GRIN2B 700/4885

“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.