SCHEMBL18859678

SCHEMBL18859678

c1ccc2c(c1)sc1nc(-c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc3)c3ccccc3c12

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 1/20 0.36
▸ GPR3 P46089 1/20 0.32
▸ LIMK1 P53667 1/20 0.32
▸ MAPT P10636 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ ADK P55263 1/20 0.32
▸ PIM3 Q86V86 1/20 0.32
▸ PIK3CA P42336 1/20 0.31
▸ PI4KA P42356 1/20 0.31
▸ PI4KB Q9UBF8 1/20 0.31
▸ PTPN1 P18031 3/20 0.31
▸ ROCK1 Q13464 2/20 0.31
▸ MKNK1 Q9BUB5 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
SCHEMBL22274328 0.92 MEN1 (0.40) ELANELIMK1MAPTALDH1A1HPGD
SCHEMBL18859604 0.92 ELANE (0.34) ELANEGPR3LIMK1MAPTALDH1A1
SCHEMBL18859625 0.90 GPR3 (0.39) ELANEGPR3LIMK1MAPTALDH1A1
SCHEMBL22274340 0.88 MEN1 (0.41) ELANEMAPTALDH1A1HPGDRAB9A
SCHEMBL18859626 0.88 NQO2 (0.38) ELANEMAPTALDH1A1HPGDADK
SCHEMBL18859620 0.87 ESR1 (0.39) ELANEMAPTALDH1A1HPGDRAB9A
SCHEMBL22274333 0.87 MEN1 (0.35) ELANELIMK1MAPTALDH1A1HPGD
SCHEMBL25924331 0.86 LIMK1 (0.36) ELANEGPR3LIMK1MAPTALDH1A1
SCHEMBL22273988 0.86 MEN1 (0.38) ELANEMAPTALDH1A1HPGDRAB9A
SCHEMBL24280211 0.85 MEN1 (0.40) MAPTALDH1A1HPGD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10644244-B2 Heterocyclic compound and organic light emitting device using same LT MATERIALS CO., LTD. (KR) 2020-05-05 — — US disclosed
US-20170141325-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME HEESUNG MATERIAL LTD. (KR) 2017-05-18 — — US disclosed
US-20170141325-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME HEESUNG MATERIAL LTD. (KR) 2017-05-18 — — 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-20170141325-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME CRY1, CRY2, CYBA ELANE 4401/4885GPR3 3579/4885LIMK1 595/4885
US-10644244-B2 Heterocyclic compound and organic light emitting device using same CRY1, CRY2, CYBA ELANE 4401/4885GPR3 3579/4885LIMK1 595/4885

“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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