SCHEMBL27705268

SCHEMBL27705268

O=C(O)c1cccc(CCc2cccc(CI)c2)c1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 3/20 0.58
GRM2 Q14416 1/20 0.48
GRM3 Q14832 1/20 0.48
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
HIF1A Q16665 1/20 0.47
ANPEP P15144 1/20 0.47
ENPEP Q07075 1/20 0.47
MEP1B Q16820 2/20 0.46
KMT2A Q03164 1/20 0.46
NR4A2 P43354 1/20 0.46
SLC16A3 O15427 1/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA6 P23280 1/20 0.46
CA9 Q16790 1/20 0.46
MEP1A Q16819 1/20 0.45
MRGPRX4 Q96LA9 1/20 0.45

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
SCHEMBL1421808 0.93 FOLH1 (0.66) FOLH1CYP2D6CYP2C9HIF1AANPEP
SCHEMBL27705284 0.91 FOLH1 (0.56) FOLH1CYP2D6CYP2C9HIF1AANPEP
SCHEMBL371526 0.89 FOLH1 (0.70) FOLH1CYP2D6CYP2C9HIF1AANPEP
SCHEMBL27686300 0.88 HDAC1 (0.46) FOLH1KMT2A
Isobutane SCHEMBL3663817 0.86 FOLH1 (0.58) FOLH1ANPEPENPEPMEP1BMRGPRX4
SCHEMBL1541757 0.85 FOLH1 (0.61) FOLH1CYP2D6CYP2C9HIF1AANPEP
SCHEMBL30395109 0.85 FOLH1 (0.66) FOLH1CYP2D6CYP2C9HIF1AANPEP
SCHEMBL1817886 0.85 FOLH1 (0.66) FOLH1CYP2D6CYP2C9HIF1AANPEP
SCHEMBL27705266 0.84 FOLH1 (0.59) FOLH1GRM2GRM3CYP2D6CYP2C9
SCHEMBL13811862 0.82 FOLH1 (0.58) FOLH1GRM2GRM3CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101955470-A Glutamate receptor potentiators LILLY CO ELI 2011-01-26 CN disclosed
CN-101061106-B Glutamate receptor potentiators LILLY CO ELI 2010-09-29 CN disclosed
CN-101061106-A Glutamate receptor potentiators LILLY CO ELI (US) 2007-10-24 CN disclosed