SCHEMBL18803452

SCHEMBL18803452

Brc1cccc(-c2nc3sc4ccccc4c3c3ccccc23)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 2/20 0.39
▸ TDO2 P48775 2/20 0.39
▸ MYC P01106 1/20 0.38
▸ WDR5 P61964 1/20 0.38
▸ RAB9A P51151 4/20 0.38
▸ NPC1 O15118 3/20 0.38
▸ MAOA P21397 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ MAPT P10636 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ RORB Q92753 1/20 0.36
▸ HK1 P19367 1/20 0.36
▸ HKDC1 Q2TB90 1/20 0.36
▸ EGFR P00533 1/20 0.36
▸ BIRC5 O15392 1/20 0.35
▸ EPAS1 Q99814 1/20 0.35
▸ ELANE P08246 1/20 0.35
▸ BRD4 O60885 1/20 0.35
▸ TSHR P16473 2/20 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
SCHEMBL18859780 0.84 MAPT (0.38) RAB9ANPC1MAPTALDH1A1EPAS1
SCHEMBL18803208 0.84 ELANE (0.40) MAPTALDH1A1HPGDELANETSHR
SCHEMBL23628372 0.83 HPGD (0.41) IDO1TDO2RAB9ANPC1MAOA
SCHEMBL18859608 0.82 ELANE (0.34) MAPTALDH1A1HPGDELANESMN1; SMN2
SCHEMBL18859604 0.82 ELANE (0.34) RAB9AMAPTALDH1A1HPGDELANE
SCHEMBL18859611 0.81 F9 (0.37) MAPTALDH1A1HPGDELANETSHR
SCHEMBL18859662 0.81 ELANE (0.34) MAPTELANE
SCHEMBL18859681 0.81 GPR3 (0.37) RAB9AMAOAMAOBMAPTALDH1A1
SCHEMBL18859614 0.81 HSD17B1 (0.39) RAB9ANPC1MAPTALDH1A1HPGD
SCHEMBL18158901 0.81 HPGD (0.39) IDO1TDO2RAB9ANPC1MAOA

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-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 (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-20170141325-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME CRY1, CRY2, CYBA IDO1 2175/4885TDO2 606/4885MYC 158/4885

“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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