SCHEMBL21693029

SCHEMBL21693029

N#Cc1ccc(-c2ccc(-c3cc(-c4ccc5sc6ccccc6c5c4)cc(-c4ccc5sc6ccccc6c5c4)c3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS12 P56730 1/20 0.44
GPR3 P46089 1/20 0.44
PIM3 Q86V86 2/20 0.40
PIM1 P11309 1/20 0.40
PIM2 Q9P1W9 1/20 0.40
LIMK1 P53667 1/20 0.39
MAP4K4 O95819 1/20 0.39
TNKS O95271 1/20 0.38
MMP3 P08254 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GABRA1 P14867 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 1/20 0.37
KIF11 P52732 1/20 0.36

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
SCHEMBL21692206 1.00 PRSS12 (0.44) PRSS12GPR3PIM3PIM1PIM2
SCHEMBL21691571 0.97 PRSS12 (0.42) PRSS12GPR3PIM3PIM1PIM2
SCHEMBL21692346 0.96 LIMK1 (0.45) PRSS12GPR3PIM3PIM1PIM2
SCHEMBL21693041 0.92 GPR3 (0.42) PRSS12GPR3PIM3PIM1PIM2
SCHEMBL21691601 0.91 GPR3 (0.39) PRSS12GPR3PIM3PIM1PIM2
SCHEMBL21691573 0.91 GPR3 (0.41) PRSS12GPR3PIM3LIMK1MAP4K4
SCHEMBL21691546 0.91 GPR3 (0.44) PRSS12GPR3PIM3PIM1PIM2
SCHEMBL21691501 0.91 GPR3 (0.44) PRSS12GPR3PIM3PIM1PIM2
SCHEMBL21692464 0.91 LIMK1 (0.48) PRSS12GPR3LIMK1MAP4K4TNKS
SCHEMBL21691547 0.90 PRSS12 (0.40) PRSS12GPR3PIM3LIMK1MAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11053228-B2 Condensed cyclic compound, composition including the condensed cyclic compound, and organic light-emitting device including the condensed cyclic compound SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-07-06 US disclosed
US-20200031812-A1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE CONDENSED CYCLIC COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE CONDENSED CYCLIC COMPOUND SAMSUNG SDI CO., LTD. (KR) 2020-01-30 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 (2 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-11053228-B2 Condensed cyclic compound, composition including the condensed cyclic compound, and organic light-emitting device including the condensed cyclic compound CCNL2, ARL1, CRY1 PRSS12 4694/4885GPR3 1463/4885PIM3 4551/4885
US-20200031812-A1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE CONDENSED CYCLIC COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE CONDENSED CYCLIC COMPOUND CCNL2, ARL1, CRY1 PRSS12 4694/4885GPR3 1463/4885PIM3 4551/4885

“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.