SCHEMBL16159663

SCHEMBL16159663

c1cc(-c2ccc3c4ccc(-c5cccc(-c6nccs6)n5)cc4n(-c4cccc5ccccc45)c3c2)nc(-c2nccs2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.41
SYK P43405 4/20 0.37
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 3/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
PDPK1 O15530 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
HPGD P15428 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HSP90AA1 P07900 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
SRC P12931 1/20 0.34
CDK2 P24941 1/20 0.34
ZAP70 P43403 1/20 0.34
PLK4 O00444 1/20 0.34
FLT3 P36888 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
CHEK1 O14757 1/20 0.33

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
SCHEMBL16159840 0.87 PDPK1 (0.44) RAB9AALDH1A1KDM4ELMNAHTT
SCHEMBL16159370 0.87 RAB9A (0.40) RAB9ASYKALDH1A1KDM4ELMNA
SCHEMBL16159316 0.86 PDPK1 (0.43) RAB9AALDH1A1KDM4ELMNAHTT
SCHEMBL16159637 0.85 PDPK1 (0.41) RAB9ASYKALDH1A1KDM4EPDPK1
SCHEMBL16159912 0.82 CYP2A6 (0.39) RAB9AALDH1A1KDM4ELMNAHTT
SCHEMBL17704347 0.80 RAB9A (0.48) RAB9ASYKALDH1A1PDPK1HPGD
SCHEMBL16159242 0.79 PIM1 (0.36) ALDH1A1KDM4ELMNAHTTMEN1
SCHEMBL16159664 0.79 RAB9A (0.34) RAB9ASYKALDH1A1KDM4EPDPK1
SCHEMBL9973679 0.78 CYP19A1 (0.43) RAB9AALDH1A1KDM4EKMT2AHPGD
SCHEMBL16159573 0.77 PTGS1 (0.35) ALDH1A1MEN1KMT2AHPGDTDP1

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-20160118598-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME JNC CORPORATION (JP) 2016-04-28 US disclosed
US-20160118598-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME JNC CORPORATION (JP) 2016-04-28 US disclosed
WO-2014163173-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME JNC株式会社 (JP) 2014-10-09 WO 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 (1 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-20160118598-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME HVCN1, VDAC1, SLC26A3 RAB9A 3067/4885SYK 4627/4885ALDH1A1 1285/4885

“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.