SCHEMBL22708573

SCHEMBL22708573

c1ccc(-c2ccc3c(c2)sc2c3c3ccccc3c3c4ccccc4n(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c23)cc1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 6/20 0.38
PIK3CA P42336 1/20 0.33
PI4KA P42356 1/20 0.33
PI4KB Q9UBF8 1/20 0.33
LIMK2 P53671 1/20 0.31
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 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
SCHEMBL22708574 0.97 LIMK1 (0.36) LIMK1PIK3CAPI4KAPI4KBLIMK2
SCHEMBL22708704 0.96 LIMK1 (0.38) LIMK1PIK3CAPI4KAPI4KBMEN1
SCHEMBL18086397 0.92 TNKS (0.32) LIMK1MEN1KMT2A
SCHEMBL21707294 0.92 TNKS (0.32) LIMK1MEN1KMT2A
SCHEMBL22199909 0.91 LIMK1 (0.32) LIMK1
SCHEMBL22708554 0.91 LIMK1 (0.33) LIMK1PIK3CAPI4KAPI4KBMEN1
SCHEMBL15126602 0.91 LIMK1 (0.38) LIMK1PIK3CAPI4KAPI4KBMEN1
SCHEMBL18086391 0.90 LIMK1 (0.31) LIMK1
SCHEMBL16206308 0.90 TNKS (0.33) MEN1ALDH1A1MAPTHPGDKMT2A
SCHEMBL22199910 0.89 KDM4E (0.33) LIMK1PIK3CAMEN1ALDH1A1KMT2A

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-11588110-B2 Heterocyclic compound and organic light emitting device comprising the same LT MATERIALS CO., LTD. (KR) 2023-02-21 US disclosed
US-20200373499-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LT MATERIALS CO., LTD. (KR) 2020-11-26 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-11588110-B2 Heterocyclic compound and organic light emitting device comprising the same CRY1, CYP1A1, CYP1B1 LIMK1 541/4885PIK3CA 4382/4885PI4KA 4042/4885
US-20200373499-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME CRY1, CYP1A1, CYP1B1 LIMK1 541/4885PIK3CA 4382/4885PI4KA 4042/4885

“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.