SCHEMBL17178138

SCHEMBL17178138

O=[PH](O)Oc1c(-c2ccc3ccc4cccnc4c3n2)cccc1-c1ccc2ccc3cccnc3c2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.46
▸ TDP1 Q9NUW8 4/20 0.46
▸ LMNA P02545 4/20 0.46
▸ MAPT P10636 3/20 0.46
▸ MMP2 P08253 2/20 0.46
▸ TSHR P16473 2/20 0.46
▸ HTT P42858 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ GMNN O75496 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ HSP90AA1 P07900 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ MMP9 P14780 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ MMP8 P22894 1/20 0.46
▸ CCR1 P32246 1/20 0.46
▸ THPO P40225 1/20 0.46
▸ MTOR P42345 1/20 0.46

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
SCHEMBL17146602 0.81 LMNA (0.33) KDM4ETDP1LMNAMAPTMMP2
SCHEMBL17146604 0.80 LMNA (0.42) KDM4ETDP1LMNAMAPTMMP2
SCHEMBL17178140 0.80 LMNA (0.42) KDM4ETDP1LMNAMAPTMMP2
SCHEMBL17146609 0.79 LMNA (0.39) KDM4ETDP1LMNAMAPTMMP2
SCHEMBL20172562 0.79 CCR1 (0.52) KDM4ETDP1LMNAMAPTMMP2
SCHEMBL15497974 0.78 CCR1 (0.64) KDM4ETDP1LMNAMAPTMMP2
SCHEMBL20154964 0.78 CCR1 (0.64) KDM4ETDP1LMNAMAPTMMP2
SCHEMBL10299989 0.77 LMNA (0.57) KDM4ETDP1LMNAMAPTMMP2
SCHEMBL14864002 0.77 KDM4E (0.48) KDM4ETDP1LMNAMAPTMMP2
SCHEMBL17146627 0.76 CCR1 (0.38) KDM4ETDP1LMNAMAPTMMP2

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-9748593-B2 Polymer electrolyte composition, and polymer electrolyte membrane, membrane electrode complex and solid polymer-type fuel cell each produced using same TORAY INDUSTRIES, INC. (JP) 2017-08-29 — — US disclosed
US-20150295262-A1 POLYMER ELECTROLYTE COMPOSITION, AND POLYMER ELECTROLYTE MEMBRANE, MEMBRANE ELECTRODE COMPLEX AND SOLID POLYMER-TYPE FUEL CELL EACH PRODUCED USING SAME TORAY INDUSTRIES, INC. (JP) 2015-10-15 — — US disclosed
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