SCHEMBL18347448

SCHEMBL18347448

N#Cc1ccc2c(c1)c1ccccc1n2-c1ccccc1-c1ccccc1-c1cccc2c3cc(C#N)ccc3n(-c3ccccc3C#N)c12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.34
HTR6 P50406 1/20 0.34
PTGER4 P35408 2/20 0.34
DUSP3 P51452 1/20 0.34
TDP2 O95551 1/20 0.33
MAT2A P31153 1/20 0.33
RPS6KB1 P23443 1/20 0.33
ROCK1 Q13464 1/20 0.33
KDM4E B2RXH2 2/20 0.33
RORC P51449 4/20 0.32
ENPP3 O14638 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HIF1A Q16665 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
KCNN4 O15554 1/20 0.31
CCNB2 O95067 1/20 0.31
CDK1 P06493 1/20 0.31
CCNB1 P14635 1/20 0.31

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
SCHEMBL18347426 1.00 HRH1 (0.34) HRH1HTR6PTGER4DUSP3TDP2
SCHEMBL18347432 1.00 HRH1 (0.34) HRH1HTR6PTGER4DUSP3TDP2
SCHEMBL18348369 0.91 TDP2 (0.38) HRH1HTR6PTGER4DUSP3TDP2
SCHEMBL18348426 0.91 TDP2 (0.38) HRH1HTR6PTGER4DUSP3TDP2
SCHEMBL18348375 0.91 TDP2 (0.38) HRH1HTR6PTGER4DUSP3TDP2
SCHEMBL18348451 0.91 PTGER4 (0.35) HRH1HTR6PTGER4DUSP3TDP2
SCHEMBL18348434 0.91 PTGER4 (0.35) HRH1HTR6PTGER4DUSP3TDP2
SCHEMBL18348438 0.91 TDP2 (0.38) HRH1HTR6PTGER4DUSP3TDP2
SCHEMBL18348387 0.91 PTGER4 (0.35) HRH1HTR6PTGER4DUSP3TDP2
SCHEMBL18348376 0.91 PTGER4 (0.35) HRH1HTR6PTGER4DUSP3TDP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160380210-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-12-29 US 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-20160380210-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNT1 HRH1 1138/4885HTR6 3497/4885PTGER4 473/4885

“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.