SCHEMBL29312663

SCHEMBL29312663

c1ccc(N(c2ccccc2)c2ccc(-c3cc(-c4ccc5sc6ccccc6c5c4)c4sc5ccccc5c4c3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.43
▸ TNKS O95271 1/20 0.37
▸ TNKS2 Q9H2K2 1/20 0.37
▸ GPR3 P46089 1/20 0.37
▸ LIMK1 P53667 1/20 0.35
▸ PIM3 Q86V86 2/20 0.34
▸ MAPT P10636 4/20 0.34
▸ L3MBTL1 Q9Y468 3/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ PTGIR P43119 1/20 0.34
▸ PTPN7 P35236 1/20 0.33
▸ DUSP3 P51452 1/20 0.33
▸ PTPN12 Q05209 1/20 0.33
▸ PTPN22 Q9Y2R2 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL29312615 0.99 ALOX5 (0.42) ALOX5TNKSTNKS2GPR3LIMK1
SCHEMBL19607059 0.97 ALOX5 (0.43) ALOX5TNKSTNKS2GPR3LIMK1
SCHEMBL19607140 0.94 LIMK1 (0.40) ALOX5TNKSTNKS2GPR3LIMK1
SCHEMBL29312609 0.92 ALOX5 (0.41) ALOX5TNKSTNKS2GPR3LIMK1
SCHEMBL29312388 0.92 TNKS (0.42) ALOX5TNKSTNKS2GPR3LIMK1
SCHEMBL29312343 0.92 TNKS (0.42) ALOX5TNKSTNKS2GPR3LIMK1
SCHEMBL29312179 0.92 TNKS (0.42) ALOX5TNKSTNKS2GPR3LIMK1
SCHEMBL18998373 0.92 TNKS (0.42) ALOX5TNKSTNKS2GPR3LIMK1
SCHEMBL29312358 0.92 TNKS (0.42) ALOX5TNKSTNKS2GPR3LIMK1
SCHEMBL29312381 0.92 TNKS (0.42) ALOX5TNKSTNKS2GPR3LIMK1

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-12041848-B2 Heterocyclic compound and organic light emitting element comprising same LG CHEM, LTD. (KR) 2024-07-16 — — US disclosed
US-12041848-B2 Heterocyclic compound and organic light emitting element comprising same LG CHEM, LTD. (KR) 2024-07-16 — — 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-12041848-B2 Heterocyclic compound and organic light emitting element comprising same CRY1, CRY2, NR2E3 ALOX5 1089/4885TNKS 3740/4885TNKS2 3550/4885

“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.

Send feedback