SCHEMBL15042999

SCHEMBL15042999

CN(C)c1nc2ccc3cc(Br)ccc3c2[nH]1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
RAB9A P51151 2/20 0.42
NPC1 O15118 2/20 0.42
SGK1 O00141 1/20 0.42
MEN1 O00255 1/20 0.42
GMNN O75496 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPT P10636 1/20 0.42
CSNK2A2 P19784 1/20 0.42
NFKB1 P19838 1/20 0.42
CCNA2 P20248 1/20 0.42
CDK2 P24941 1/20 0.42
MAPK1 P28482 1/20 0.42
THPO P40225 1/20 0.42
MTOR P42345 1/20 0.42
BLM P54132 1/20 0.42
CSNK2B P67870 1/20 0.42
CSNK2A1 P68400 1/20 0.42
CCNA1 P78396 1/20 0.42
PMP22 Q01453 1/20 0.42

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
SCHEMBL17973095 0.80 TYMS (0.54) LMNARAB9ANPC1MAPTCSNK2A1
SCHEMBL16440333 0.76 ERN1 (0.41) MEN1MAPTKMT2ATYMSPTGES
SCHEMBL481951 0.76 ALDH1A1 (0.56) LMNARAB9AMAPTALDH1A1
SCHEMBL15042998 0.73 LPL (0.36) LMNARAB9ANPC1SGK1MEN1
SCHEMBL21145874 0.73 BACE1 (0.37) LMNARAB9ATYMSPTGESBACE1
SCHEMBL3051488 0.72 ALDH1A1 (0.40) LMNARAB9ANPC1SGK1MEN1
SCHEMBL29959587 0.72 PTGES (0.51) RAB9ANPC1MEN1CYP3A4MAPT
SCHEMBL26693457 0.72 PTGES (0.51) RAB9ANPC1MEN1CYP3A4MAPT
SCHEMBL12294840 0.71 LMNA (0.36) LMNARAB9ACSNK2A1DYRK1ATYMS
SCHEMBL13560994 0.71 LMNA (0.36) LMNARAB9ACSNK2A1DYRK1ATYMS

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-20130156731-A1 FUSED TRICYCLIC COMPOUNDS AND METHODS OF USE THEREOF FOR THE TREATMENT OF VIRAL DISEAS SCHERING CORPORATION 2013-06-20 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-20130156731-A1 FUSED TRICYCLIC COMPOUNDS AND METHODS OF USE THEREOF FOR THE TREATMENT OF VIRAL DISEAS HAVCR2, ELOC, ZC3HAV1 LMNA 1245/4885RAB9A 3293/4885NPC1 193/4885

“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.