SCHEMBL16189447

SCHEMBL16189447

Cc1ncccc1-c1cccc(C2=C(c3ccccc3)C(c3ccccc3)=C(c3cccc(-c4cccnc4C)n3)[Si]2(C)C)n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.37
MEN1 O00255 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
ELANE P08246 1/20 0.34
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
ALPL P05186 1/20 0.34
HSP90AA1 P07900 1/20 0.34
ALPI P09923 1/20 0.34
ALPG P10696 1/20 0.34
ALOX15 P16050 1/20 0.34
MAPK1 P28482 1/20 0.34
CCR1 P32246 1/20 0.34
HTT P42858 1/20 0.34
CCR5 P51681 1/20 0.34
CCR8 P51685 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL127151 0.81 KDM4E (0.56) MEN1RAB9AKMT2AKDM4ELMNA
SCHEMBL6252806 0.79 KMT2A (0.59) MEN1RAB9AKMT2AKDM4EHSP90AA1
SCHEMBL18385057 0.79 KDM4E (0.53) MEN1RAB9AKMT2AKDM4ELMNA
SCHEMBL6258933 0.79 ALDH1A1 (0.43) MEN1RAB9AKMT2AKDM4ETP53
SCHEMBL17532899 0.77 CCR1 (0.52) MEN1RAB9AKMT2AKDM4ECCR1
SCHEMBL16189450 0.77 CYP2A6 (0.41) MEN1RAB9AKMT2AELANETDP1
SCHEMBL6258557 0.76 CCR1 (0.50) MEN1RAB9AKMT2AKDM4ETP53
SCHEMBL5718628 0.76 NPY5R (0.41) RAB9AKDM4ELMNATP53CCR1
SCHEMBL7116753 0.76 KDM4E (0.46) MEN1RAB9AKMT2AKDM4ELMNA
SCHEMBL17532891 0.76 ELANE (0.35) DHODHRAB9AELANEKDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9780310-B2 Heterocyclic compound for organic electroluminescent device and its application TOSOH CORPORATION (JP) 2017-10-03 US disclosed
US-9780310-B2 Heterocyclic compound for organic electroluminescent device and its application TOSOH CORPORATION (JP) 2017-10-03 US disclosed
US-20160056388-A1 HETEROCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ITS APPLICATION TOSOH CORPORATION (JP) 2016-02-25 US disclosed
US-20160056388-A1 HETEROCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ITS APPLICATION TOSOH CORPORATION (JP) 2016-02-25 US disclosed
WO-2014171541-A1 HETEROCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE ELEMENT AND APPLICATION THEREFOR 東ソー株式会社 (JP) 2014-10-23 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-20160056388-A1 HETEROCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ITS APPLICATION AOC2, AZI2, KCNH2 DHODH 1597/4885MEN1 2195/4885RAB9A 2520/4885

“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.