SCHEMBL22006504

SCHEMBL22006504

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc4c3sc3ccc(-c5cccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)c5)cc34)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.39
PIM1 P11309 6/20 0.37
PIM2 Q9P1W9 6/20 0.37
PIM3 Q86V86 3/20 0.37
ATM Q13315 2/20 0.35
KDM4E B2RXH2 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
AVPR1A P37288 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
SCHEMBL22006908 0.99 LIMK1 (0.37) LIMK1PIM1PIM2PIM3ATM
SCHEMBL22006537 0.98 LIMK1 (0.39) LIMK1PIM1PIM2PIM3ATM
SCHEMBL22006963 0.98 LIMK1 (0.40) LIMK1PIM1PIM2PIM3ATM
SCHEMBL22006505 0.95 LIMK1 (0.39) LIMK1PIM1PIM2PIM3ATM
SCHEMBL23086064 0.94 ATM (0.37) LIMK1PIM1PIM2PIM3ATM
SCHEMBL22006892 0.94 LIMK1 (0.40) LIMK1PIM1PIM2PIM3ATM
SCHEMBL22006907 0.94 LIMK1 (0.38) LIMK1PIM1PIM2PIM3ATM
SCHEMBL22006581 0.93 LIMK1 (0.41) LIMK1PIM1PIM2PIM3ATM
SCHEMBL22006895 0.93 LIMK1 (0.38) LIMK1PIM1PIM2PIM3ATM
SCHEMBL22006598 0.93 LIMK1 (0.41) LIMK1PIM1PIM2PIM3ATM

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-20200161564-A1 ORGANIC COMPOUND, COMPOSITION, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-05-21 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-20200161564-A1 ORGANIC COMPOUND, COMPOSITION, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE OXER1, OR10J3, OCIAD1 LIMK1 362/4885PIM1 4316/4885PIM2 4399/4885

“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.