SCHEMBL21923736

SCHEMBL21923736

c1ccc(-c2ccc3c(-n4c5cc(-c6ccccc6)ccc5c5cc6ccccc6cc54)nc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)nc3c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 5/20 0.39
KDM4E B2RXH2 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CYP1A2 P05177 4/20 0.36
CYP3A4 P08684 4/20 0.36
CYP2D6 P10635 4/20 0.36
TP53 P04637 2/20 0.36
TSHR P16473 2/20 0.36
ROCK2 O75116 2/20 0.36
ROCK1 Q13464 1/20 0.36
PKN1 Q16512 1/20 0.36
PKN2 Q16513 1/20 0.36
ACP1 P24666 2/20 0.36
HRH4 Q9H3N8 1/20 0.35
LMNA P02545 1/20 0.35
USP2 O75604 1/20 0.35
MAPK1 P28482 1/20 0.35
CLK4 Q9HAZ1 1/20 0.35
DHFR P00374 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
SCHEMBL21213751 1.00 ABCG2 (0.39) ABCG2KDM4EATML3MBTL1CYP1A2
SCHEMBL21924908 0.98 ABCG2 (0.38) ABCG2KDM4EATML3MBTL1CYP1A2
SCHEMBL21212919 0.98 ABCG2 (0.37) ABCG2KDM4EATML3MBTL1CYP1A2
SCHEMBL21212921 0.97 ABCG2 (0.39) ABCG2KDM4EATML3MBTL1CYP1A2
SCHEMBL21923588 0.95 ROCK2 (0.36) ABCG2KDM4EATML3MBTL1CYP1A2
SCHEMBL21923640 0.95 ABCG2 (0.41) ABCG2KDM4EATML3MBTL1CYP1A2
SCHEMBL21212860 0.93 ABCG2 (0.41) ABCG2KDM4EATML3MBTL1CYP1A2
SCHEMBL21212861 0.93 KDM4E (0.43) ABCG2KDM4EATML3MBTL1CYP1A2
SCHEMBL21213676 0.92 ACP1 (0.42) ABCG2KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL21213517 0.92 ACP1 (0.42) ABCG2KDM4ECYP1A2CYP3A4CYP2D6

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-20200136058-A1 BENZOCARBAZOLE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, 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-20200136058-A1 BENZOCARBAZOLE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CYP1B1, CYP2C9, CYP1A1 ABCG2 867/4885KDM4E 1216/4885ATM 3830/4885

“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.