SCHEMBL2301796

SCHEMBL2301796

CC(C)Oc1cccc(-c2ccccc2)n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
RAB9A P51151 1/20 0.54
ASIC3 Q9UHC3 1/20 0.46
GABRA1 P14867 2/20 0.44
GABRG2 P18507 2/20 0.44
GABRB3 P28472 2/20 0.44
GABRA5 P31644 2/20 0.44
GABRA3 P34903 2/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44
KCNH2 Q12809 1/20 0.44
PIM1 P11309 9/20 0.40
PIM2 Q9P1W9 8/20 0.40
PIM3 Q86V86 5/20 0.40
TRPV3 Q8NET8 1/20 0.40
MAPT P10636 1/20 0.39
TSHR P16473 1/20 0.39
ATM Q13315 1/20 0.39
MAP4K4 O95819 1/20 0.39

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
SCHEMBL2523502 0.84 KMT2A (0.42) MEN1KMT2AGABRA1GABRG2GABRB3
SCHEMBL11204613 0.82 CYP1A2 (0.53) MEN1KMT2ARAB9AASIC3SLC6A2
SCHEMBL11208730 0.82 TRPV3 (0.48) MEN1KMT2ARAB9AASIC3SLC6A2
SCHEMBL11209392 0.82 MEN1 (0.46) MEN1KMT2ARAB9AASIC3GABRA1
SCHEMBL11205319 0.80 MEN1 (0.44) MEN1KMT2ARAB9AASIC3SLC6A2
SCHEMBL1360819 0.79 RAB9A (0.60) MEN1KMT2ARAB9AASIC3SLC6A2
SCHEMBL16334722 0.78 FFAR4 (0.42) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL11208348 0.78 KLK7 (0.44) MEN1KMT2ARAB9ATRPV3MAPT
SCHEMBL5103779 0.78 MEN1 (0.65) MEN1KMT2ARAB9AASIC3SLC6A2
SCHEMBL12093710 0.76 KDR (0.43) MEN1KMT2AMAPTATMCYP1A2

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-8461183-B2 PPAR agonist compounds, preparation and uses GENFIT (FR) 2013-06-11 US disclosed
US-20110195993-A1 PPAR AGONIST COMPOUNDS, PREPARATION AND USES GENFIT (FR) 2011-08-11 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-20110195993-A1 PPAR AGONIST COMPOUNDS, PREPARATION AND USES PPARD, PPARA, PPARG MEN1 4851/4885KMT2A 3347/4885RAB9A 2825/4885

“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.