SCHEMBL12896237

SCHEMBL12896237

CCc1cc(C(C)C)c(F)cc1F

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.38
EIF4A3 P38919 1/20 0.38
ALOX15 P16050 1/20 0.32
ALOX12 P18054 1/20 0.32
FABP3 P05413 1/20 0.31
FABP4 P15090 1/20 0.31
FABP5 Q01469 1/20 0.31
NAAA Q02083 1/20 0.30
PDE2A O00408 1/20 0.30
ADRB2 P07550 1/20 0.30
ADRB1 P08588 1/20 0.30
ADRB3 P13945 1/20 0.30

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
SCHEMBL14404558 0.91 DPP4 (0.38) DPP4EIF4A3ALOX15ALOX12FABP3
SCHEMBL22019113 0.87 EIF4A3 (0.38) DPP4EIF4A3ALOX15ALOX12FABP3
SCHEMBL27308803 0.83 EIF4A3 (0.36) EIF4A3ALOX15ALOX12
SCHEMBL13413598 0.82 GRIN2D (0.39) EIF4A3ALOX15ALOX12PDE2A
SCHEMBL10552802 0.82 EIF4A3 (0.35) EIF4A3PDE2A
SCHEMBL13592734 0.81 DPP4 (0.37) DPP4EIF4A3ADRB2ADRB1ADRB3
SCHEMBL16736709 0.79 ALOX15 (0.42) EIF4A3ALOX15ALOX12ADRB2ADRB1
SCHEMBL23731995 0.79 TAAR1 (0.42)
SCHEMBL9886089 0.79 TAAR1 (0.50)
SCHEMBL13319560 0.78 EIF4A3 (0.41) DPP4EIF4A3FABP3FABP4PDE2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019118358-A1 HEPATITIS B CAPSID ASSEMBLY MODULATORS VenatoRx Pharmaceuticals, Inc. (US) 2019-06-20 WO disclosed
US-8507723-B2 Polycationic compounds and uses thereof POLYMEDIX, INC. (US) 2013-08-13 US disclosed
US-20120322878-A1 Polycationic Compounds And Uses Thereof POLYMEDIX, INC. (US) 2012-12-20 US disclosed
US-7893224-B2 Oligonucleotides comprising a ligand tethered to a modified or non-natural nucleobase ALNYLAM PHARMACEUTICALS, INC. (US) 2011-02-22 US disclosed
US-7745662-B2 Polycationic compounds and uses thereof POLYMEDIX, INC. (US) 2010-06-29 US disclosed
US-20090312531-A1 OLIGNUCLEOTIDES COMPRISING A LIGAND TETHERED TO A MODIFIED OR NON-NATURAL NUCLEOBASE ALNYLAM PHARMACEUTICALS, INC. (US) 2009-12-17 US disclosed
US-7632932-B2 Oligonucleotides comprising a ligand tethered to a modified or non-natural nucleobase ALNYLAM PHARMACEUTICALS, INC. (US) 2009-12-15 US disclosed
US-20070054279-A1 Oligonucleotides comprising a ligand tethered to a modified or non-natural nucleobase ALNYLAM PHARMACEUTICALS (US) 2007-03-08 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 (3 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-20090312531-A1 OLIGNUCLEOTIDES COMPRISING A LIGAND TETHERED TO A MODIFIED OR NON-NATURAL NUCLEOBASE DUT, NOP58, DPYD DPP4 2435/4885EIF4A3 624/4885ALOX15 3219/4885
US-20120322878-A1 Polycationic Compounds And Uses Thereof VEGFA, VHL, PGF DPP4 1901/4885EIF4A3 1552/4885ALOX15 1107/4885
US-20070054279-A1 Oligonucleotides comprising a ligand tethered to a modified or non-natural nucleobase DERA, NT5C3B, DUT DPP4 1619/4885EIF4A3 871/4885ALOX15 3305/4885

“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.