SCHEMBL26458485

SCHEMBL26458485

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3ccc(-c5cnc6ccccc6n5)cc3-4)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 10/20 0.44
RAB9A P51151 10/20 0.44
KMT2A Q03164 5/20 0.39
JAK2 O60674 2/20 0.38
JAK3 P52333 4/20 0.36
MAPT P10636 2/20 0.36
HTT P42858 2/20 0.36
MITF O75030 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
TLR9 Q9NR96 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
TP53 P04637 1/20 0.36
STAT1 P42224 1/20 0.36
BCHE P06276 1/20 0.36
MEN1 O00255 4/20 0.35
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 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
SCHEMBL26458556 0.93 NPC1 (0.42) NPC1RAB9AKMT2AJAK2JAK3
SCHEMBL26458606 0.90 NPC1 (0.39) NPC1RAB9AKMT2AJAK2MAPT
SCHEMBL26457982 0.89 NPC1 (0.40) NPC1RAB9AKMT2AJAK2JAK3
SCHEMBL26458296 0.88 NPC1 (0.43) NPC1RAB9AKMT2AJAK2JAK3
SCHEMBL26458496 0.87 MEN1 (0.46) NPC1RAB9AKMT2AMAPTALDH1A1
SCHEMBL26458215 0.87 MEN1 (0.36) NPC1RAB9AKMT2AMAPTALDH1A1
SCHEMBL26458393 0.87 NPC1 (0.38) NPC1RAB9AKMT2AJAK2MAPT
SCHEMBL22216509 0.86 MEN1 (0.35) NPC1RAB9AKMT2AMAPTHTT
SCHEMBL22216544 0.86 MEN1 (0.35) NPC1RAB9AKMT2AMAPTHTT
SCHEMBL26458233 0.86 MEN1 (0.35) KMT2AMAPTALDH1A1LMNAMEN1

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-11641778-B2 Compound and organic light emitting device comprising same LG CHEM, LTD. (KR) 2023-05-02 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-11641778-B2 Compound and organic light emitting device comprising same CRY1, CYP1A1, CRY2 NPC1 1521/4885RAB9A 2344/4885KMT2A 1182/4885

“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.