SCHEMBL19829356

SCHEMBL19829356

CCCCCCCCCCc1cc(N)cc(N)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 4/20 0.57
CYP3A4 P08684 2/20 0.54
HTR2A P28223 1/20 0.52
GPR84 Q9NQS5 3/20 0.50
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HSD17B10 Q99714 2/20 0.47
MEN1 O00255 1/20 0.47
USP2 O75604 1/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
HPGD P15428 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ESR1 P03372 2/20 0.47
ADRA2A P08913 2/20 0.47
ADORA3 P0DMS8 2/20 0.47
TACR2 P21452 2/20 0.47
SLC6A2 P23975 2/20 0.47

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
SCHEMBL9118087 1.00 PTGS2 (0.57) PTGS2CYP3A4HTR2AGPR84KDM4E
SCHEMBL10492707 1.00 PTGS2 (0.57) PTGS2CYP3A4HTR2AGPR84KDM4E
SCHEMBL6681772 1.00 PTGS2 (0.57) PTGS2CYP3A4HTR2AGPR84KDM4E
SCHEMBL19513925 1.00 PTGS2 (0.57) PTGS2CYP3A4HTR2AGPR84KDM4E
SCHEMBL28579097 0.98 PTGS2 (0.56) PTGS2CYP3A4HTR2AGPR84KDM4E
SCHEMBL15804002 0.95 PTGS2 (0.57) PTGS2CYP3A4HTR2AGPR84KDM4E
SCHEMBL9170666 0.95 PTGS2 (0.57) PTGS2CYP3A4HTR2AGPR84KDM4E
SCHEMBL9168375 0.95 PTGS2 (0.57) PTGS2CYP3A4HTR2AGPR84KDM4E
SCHEMBL7895255 0.93 PTGS2 (0.56) PTGS2CYP3A4HTR2AGPR84KDM4E
SCHEMBL10492558 0.91 HPGD (0.50) PTGS2CYP3A4HTR2AGPR84KDM4E

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
US-20180205242-A1 CAPACITOR BASED POWER SYSTEM AND UNMANNED VEHICLE WITH THE CAPACITOR BASED POWER SYSTEM THEREOF CAPACITOR SCIENCES INCORPORATED 2018-07-19 US disclosed
US-20180137984-A1 SOLID STATE ENERGY STORAGE DEVICE CAPACITOR SCIENCES INCORPORATED 2018-05-17 US disclosed
US-20180033554-A1 YANLI DIELECTRIC MATERIALS AND CAPACITOR THEREOF CAPACITOR SCIENCES INCORPORATED 2018-02-01 US disclosed