SCHEMBL21315919

SCHEMBL21315919

C1=Cc2c(sc3ncccc23)C=NC1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LIMK1 P53667 3/20 0.35
▸ CLK1 P49759 2/20 0.35
▸ IKBKB O14920 1/20 0.35
▸ CHUK O15111 1/20 0.35
▸ CDC7 O00311 1/20 0.35
▸ DBF4 Q9UBU7 1/20 0.35
▸ HPGD P15428 1/20 0.33
▸ PIK3CA P42336 1/20 0.32
▸ PRKCI P41743 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 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
SCHEMBL21315925 0.75 LIMK1 (0.36) LIMK1CLK1
SCHEMBL26276459 0.72 HPGD (0.34) LIMK1CLK1IKBKBCHUKCDC7
SCHEMBL21315915 0.71 — —
SCHEMBL19721360 0.69 HPGD (0.36) LIMK1CLK1IKBKBCHUKCDC7
SCHEMBL21315924 0.69 CYP2A6 (0.33) —
SCHEMBL19721362 0.69 HPGD (0.36) LIMK1CLK1IKBKBCHUKCDC7
SCHEMBL4903332 0.67 LIMK1 (0.50) LIMK1CLK1IKBKBCHUKCDC7
SCHEMBL21315922 0.66 KDM4E (0.41) HPGDPIK3CAKDM4EALDH1A1
SCHEMBL19309704 0.59 LIMK1 (0.35) LIMK1CLK1IKBKBCHUKCDC7
SCHEMBL24623623 0.59 LIMK1 (0.51) LIMK1CLK1IKBKBCHUKCDC7

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-10403826-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2019-09-03 — — 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-10403826-B2 Organic electroluminescent materials and devices OCIAD2, OCIAD1, JUND LIMK1 1839/4885CLK1 2668/4885IKBKB 4445/4885

“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.

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