SCHEMBL19960358

SCHEMBL19960358

Clc1ccccc1-c1ccccc1-c1nc2ccccc2[nH]1

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 9/20 0.87
▸ RAB9A P51151 9/20 0.87
▸ ALDH1A1 P00352 6/20 0.87
▸ KDM4E B2RXH2 6/20 0.87
▸ GPR55 Q9Y2T6 1/20 0.87
▸ SMN1; SMN2 Q16637 5/20 0.60
▸ HPGD P15428 4/20 0.60
▸ NPSR1 Q6W5P4 3/20 0.60
▸ HSD17B10 Q99714 3/20 0.60
▸ GAA P10253 3/20 0.60
▸ PKM P14618 2/20 0.60
▸ TP53 P04637 2/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.60
▸ ABCB11 O95342 1/20 0.60
▸ GLA P06280 1/20 0.60
▸ MAPT P10636 1/20 0.60
▸ HTT P42858 1/20 0.60
▸ AMY1A P0DUB6 2/20 0.56
▸ GUSB P08236 1/20 0.54
▸ GBA1 P04062 1/20 0.54

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
SCHEMBL162191 0.93 NPC1 (1.00) NPC1RAB9AALDH1A1KDM4EGPR55
SCHEMBL29695905 0.93 NPC1 (1.00) NPC1RAB9AALDH1A1KDM4EGPR55
SCHEMBL19960371 0.89 NPC1 (0.73) NPC1RAB9AALDH1A1KDM4EGPR55
SCHEMBL10041666 0.88 ALDH1A1 (0.72) NPC1RAB9AALDH1A1KDM4EGPR55
SCHEMBL10041699 0.88 ALDH1A1 (0.72) NPC1RAB9AALDH1A1KDM4EGPR55
SCHEMBL227743 0.87 NPC1 (0.78) NPC1RAB9AALDH1A1KDM4EGPR55
SCHEMBL19960368 0.87 NPC1 (0.76) NPC1RAB9AALDH1A1KDM4EGPR55
SCHEMBL10041654 0.86 ALDH1A1 (0.69) NPC1RAB9AALDH1A1KDM4EGPR55
SCHEMBL10041697 0.86 ALDH1A1 (0.65) NPC1RAB9AALDH1A1KDM4EGPR55
SCHEMBL19960367 0.85 RAB9A (0.79) NPC1RAB9AALDH1A1KDM4EGPR55

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-10700289-B2 Heterocyclic compound and organic light emitting element comprising same LG CHEM, LTD. (KR) 2020-06-30 — — US disclosed
US-20180076395-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-03-15 — — US disclosed
US-20180076395-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-03-15 — — 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-20180076395-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, PER2 NPC1 3974/4885RAB9A 2901/4885ALDH1A1 750/4885
US-10700289-B2 Heterocyclic compound and organic light emitting element comprising same CRY1, CRY2, PER2 NPC1 3974/4885RAB9A 2901/4885ALDH1A1 750/4885

“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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