SCHEMBL21927705

SCHEMBL21927705

CC1(C)c2ccccc2N(c2cccc(-c3cccnc3C#N)c2)c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.41
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
KDM4E B2RXH2 1/20 0.34
TP53 P04637 1/20 0.34
PGR P06401 3/20 0.34
GRM5 P41594 5/20 0.34
GABRA1 P14867 2/20 0.34
GABRG2 P18507 2/20 0.34
GABRB3 P28472 2/20 0.34
GABRA5 P31644 2/20 0.34
GABRA3 P34903 2/20 0.34
GABRA2 P47869 1/20 0.34
ALDH1A1 P00352 1/20 0.33
HTT P42858 1/20 0.33
HSD17B10 Q99714 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.33
BACE1 P56817 1/20 0.33
METAP2 P50579 1/20 0.32
EGLN1 Q9GZT9 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
SCHEMBL21927338 0.98 AR (0.40) ARPRMT5WDR77KDM4ETP53
SCHEMBL21927999 0.96 AR (0.40) ARPRMT5WDR77KDM4ETP53
SCHEMBL21927291 0.95 AR (0.39) ARPRMT5WDR77KDM4ETP53
SCHEMBL21922017 0.90 ALDH1A1 (0.39) ARPRMT5WDR77PGRGRM5
SCHEMBL21927579 0.86 PRMT5 (0.38) PRMT5WDR77KDM4ETP53GRM5
SCHEMBL21927997 0.85 AR (0.42) ARKDM4ETP53PGRGABRA1
SCHEMBL21927577 0.84 PRMT5 (0.36) ARPRMT5WDR77KDM4ETP53
SCHEMBL21927981 0.83 ALDH1A1 (0.38) PRMT5WDR77KDM4ETP53GRM5
SCHEMBL21929624 0.83 HTT (0.41) ARPRMT5WDR77PGRGRM5
SCHEMBL21927578 0.83 AR (0.36) ARPGRGRM5GABRA1GABRG2

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-20200131150-A1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE SAME AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-04-30 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-20200131150-A1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE SAME AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CCNT1, CCNA1, CCNE2 AR 1957/4885PRMT5 3681/4885WDR77 3719/4885

“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.