SCHEMBL7194702

SCHEMBL7194702

CC(C)(C)NNc1ccccn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
MAPK10 P53779 1/20 0.47
GFER P55789 1/20 0.47
KMT2A Q03164 1/20 0.47
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
PKM P14618 2/20 0.44
GAA P10253 5/20 0.43
KDM4E B2RXH2 4/20 0.42
ALDH1A1 P00352 2/20 0.42
CXCR4 P61073 1/20 0.42
CYP2C19 P33261 1/20 0.42
TSHR P16473 1/20 0.42
ATM Q13315 1/20 0.42
FABP1 P07148 1/20 0.41
FABP6 P51161 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL23352486 0.81 CXCR4 (0.42) MEN1MAPK10GFERKMT2ANPC1
SCHEMBL10405315 0.79 MEN1 (0.61) MEN1MAPK10GFERKMT2ANPC1
SCHEMBL28069466 0.79 KDM4E (0.47) MEN1MAPK10GFERKMT2ANPC1
SCHEMBL7448182 0.78 MEN1 (0.50) MEN1MAPK10GFERKMT2ANPC1
Hydrochloric Acid SCHEMBL8742967 0.77 MEN1 (0.58) MEN1MAPK10GFERKMT2ANPC1
SCHEMBL28279163 0.77 MEN1 (0.48) MEN1MAPK10GFERKMT2ANPC1
SCHEMBL2227737 0.76
SCHEMBL19581189 0.72 MEN1 (0.48) MEN1MAPK10GFERKMT2ANPC1
SCHEMBL28591049 0.72 GAA (0.62) GFERKMT2ANPC1RAB9APKM
SCHEMBL7018736 0.71

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080194545-A1 ANTIMICROBIAL COMPOSITIONS AND METHODS OF USE TRIUS THERAPEUTICS (US) 2008-08-14 US disclosed
US-20080194545-A1 ANTIMICROBIAL COMPOSITIONS AND METHODS OF USE TRIUS THERAPEUTICS (US) 2008-08-14 US disclosed
WO-2003035070-A1 ANTIHISTAMINIC/ANTITUSSIVE COMPOSITIONS MEDPOINTE HEALTHCARE, INC. (US) 2003-05-01 WO disclosed
US-20030083354-A1 Phenylephrine tannate and pyrilamine tannate salts in pharmaceutical compositions PEDIAMED PHARMACEUTICALS, INC. 2003-05-01 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-20080194545-A1 ANTIMICROBIAL COMPOSITIONS AND METHODS OF USE ABCB11, FPR1, C5 MEN1 1366/4885MAPK10 4133/4885GFER 1131/4885

“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.