SCHEMBL18273085

SCHEMBL18273085

c1ccc(-c2ccc3c(c2)c2cc(-c4cccc(-c5nc(-c6ccccc6)nc6c5sc5ccccc56)c4)ccc2n3-c2ccccc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.36
PIM1 P11309 3/20 0.35
PIM2 Q9P1W9 3/20 0.35
PIM3 Q86V86 2/20 0.35
TNKS O95271 2/20 0.33
TNKS2 Q9H2K2 2/20 0.33
AVPR1A P37288 1/20 0.32
ATM Q13315 2/20 0.32
KDM4E B2RXH2 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PTGER4 P35408 1/20 0.31
PIK3CA P42336 2/20 0.31
PI4KA P42356 1/20 0.31
PI4KB Q9UBF8 1/20 0.31
RORB Q92753 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MEN1 O00255 1/20 0.30

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
SCHEMBL18273096 1.00 LIMK1 (0.36) LIMK1PIM1PIM2PIM3TNKS
SCHEMBL18273089 0.97 ATM (0.37) LIMK1PIM1PIM2PIM3TNKS
SCHEMBL18273075 0.97 ATM (0.37) LIMK1PIM1PIM2PIM3TNKS
SCHEMBL18273052 0.96 KDM4E (0.36) LIMK1PIM1PIM2PIM3TNKS
SCHEMBL16905693 0.96 KDM4E (0.36) LIMK1PIM1PIM2PIM3TNKS
SCHEMBL18273090 0.96 LIMK1 (0.36) LIMK1PIM1PIM2PIM3TNKS
SCHEMBL16905695 0.96 LIMK1 (0.36) LIMK1PIM1PIM2PIM3TNKS
SCHEMBL18273044 0.95 ATM (0.38) LIMK1PIM1PIM2PIM3TNKS
SCHEMBL16905697 0.94 KDM4E (0.35) LIMK1PIM1PIM2PIM3TNKS
SCHEMBL22006612 0.94 LIMK1 (0.39) LIMK1PIM1PIM2PIM3AVPR1A

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-20160351826-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG SDI CO., LTD. (KR) 2016-12-01 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-20160351826-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNE2 LIMK1 1263/4885PIM1 3689/4885PIM2 3667/4885

“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.