SCHEMBL28317844

SCHEMBL28317844

O=[C]C(c1ccc(Oc2ccccc2)cc1)(c1ccc(Oc2ccccc2)cc1)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 5/20 0.50
TSHR P16473 1/20 0.50
NR1H2 P55055 1/20 0.45
BAX Q07812 1/20 0.45
MAOA P21397 1/20 0.45
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA9 Q16790 2/20 0.42
GSTP1 P09211 1/20 0.42
SOS1 Q07889 1/20 0.42
PARP10 Q53GL7 1/20 0.42
PGR P06401 2/20 0.42
SRD5A2 P31213 1/20 0.41
MGLL Q99685 1/20 0.40
MMP2 P08253 1/20 0.40
MMP8 P22894 1/20 0.40
MMP14 P50281 1/20 0.40
CA14 Q9ULX7 1/20 0.40
FFAR1 O14842 1/20 0.39
HTT P42858 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
SCHEMBL160529 0.79 KCNN4 (0.41) TSHRCA1CA2CA9
SCHEMBL29675065 0.75 LTA4H (0.45) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL11576945 0.74 LTA4H (0.92) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL435149 0.74 LTA4H (0.92) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL22129853 0.74 LTA4H (0.92) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL122719 0.74 LTA4H (0.92) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL3893562 0.74 LTA4H (0.92) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL9212518 0.74 LTA4H (0.92) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL25862884 0.73 LTA4H (0.60) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL1552420 0.72 ESR1 (0.54) LTA4HTSHRNR1H2BAXMAOA

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
CN-110317322-A Granular amine-functional polyaryl ether ketone polymer and its copolymer 塞特工业公司 2019-10-11 CN disclosed
CN-106661205-B Particulate amine-functionalized polyaryletherketone polymers and copolymers thereof 塞特工业公司 2019-08-06 CN disclosed