SCHEMBL18803208

SCHEMBL18803208

c1ccc(-c2nc3sc4ccccc4c3c3ccccc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 1/20 0.40
▸ NUDT1 P36639 3/20 0.40
▸ ADORA2A P29274 1/20 0.40
▸ GPR3 P46089 1/20 0.39
▸ ALDH1A1 P00352 6/20 0.37
▸ MAPT P10636 6/20 0.37
▸ KDM4E B2RXH2 4/20 0.37
▸ HPGD P15428 2/20 0.37
▸ GAA P10253 2/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ NPSR1 Q6W5P4 3/20 0.36
▸ ATM Q13315 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ ADK P55263 1/20 0.35
▸ HTT P42858 1/20 0.35

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
SCHEMBL18859597 0.92 MEN1 (0.47) ELANENUDT1ADORA2AGPR3ALDH1A1
SCHEMBL18859627 0.88 ELANE (0.36) ELANENUDT1ADORA2AGPR3ALDH1A1
SCHEMBL22274507 0.87 ELANE (0.37) ELANENUDT1GPR3ALDH1A1MAPT
SCHEMBL18859780 0.87 MAPT (0.38) ELANEADORA2AGPR3ALDH1A1MAPT
SCHEMBL18859608 0.85 ELANE (0.34) ELANENUDT1ADORA2AGPR3ALDH1A1
SCHEMBL22274340 0.85 MEN1 (0.41) ELANENUDT1ADORA2AALDH1A1MAPT
SCHEMBL18859678 0.85 ELANE (0.36) ELANEGPR3ALDH1A1MAPTHPGD
SCHEMBL18859662 0.84 ELANE (0.34) ELANENUDT1ADORA2AGPR3MAPT
SCHEMBL22274328 0.84 MEN1 (0.40) ELANENUDT1ADORA2AALDH1A1MAPT
SCHEMBL18859625 0.84 GPR3 (0.39) ELANENUDT1GPR3ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3162806-B1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME LT MATERIALS CO LTD (KR) 2023-08-23 — — EP disclosed
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
EP-3162806-A2 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME Heesung Material Ltd. (KR) 2017-05-03 — — EP 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 4401/4885NUDT1 170/4885ADORA2A 2164/4885
US-10644244-B2 Heterocyclic compound and organic light emitting device using same CRY1, CRY2, CYBA ELANE 4401/4885NUDT1 170/4885ADORA2A 2164/4885

“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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