SCHEMBL22472407

SCHEMBL22472407

c1ccc2c(c1)oc1nc3ncccc3n12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.48
RAB9A P51151 3/20 0.48
GABRP O00591 2/20 0.44
GABRD O14764 2/20 0.44
GABRA1 P14867 2/20 0.44
GABRB1 P18505 2/20 0.44
GABRG2 P18507 2/20 0.44
GABRB3 P28472 2/20 0.44
GABRA5 P31644 2/20 0.44
GABRA3 P34903 2/20 0.44
GABRA2 P47869 2/20 0.44
GABRB2 P47870 2/20 0.44
GABRA4 P48169 2/20 0.44
GABRE P78334 2/20 0.44
GABRA6 Q16445 2/20 0.44
GABRG1 Q8N1C3 2/20 0.44
GABRG3 Q99928 2/20 0.44
GABRQ Q9UN88 2/20 0.44
KMT2A Q03164 1/20 0.41
KDM4E B2RXH2 3/20 0.39

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
SCHEMBL22472368 0.82 NPC1 (0.47) NPC1RAB9AGABRPGABRDGABRA1
SCHEMBL23504051 0.80 NPC1 (0.44) NPC1RAB9AGABRPGABRDGABRA1
SCHEMBL22472576 0.77 GABRP (0.36) NPC1RAB9AGABRPGABRDGABRA1
SCHEMBL17491659 0.75 NPC1 (0.66) NPC1RAB9AGABRPGABRDGABRA1
SCHEMBL20678333 0.71 NPC1 (0.49) NPC1RAB9AGABRPGABRDGABRA1
SCHEMBL17507238 0.70 NPC1 (0.45) NPC1RAB9AKMT2AKDM4EPDE2A
SCHEMBL18805403 0.70 KMT2A (0.46) NPC1RAB9AGABRPGABRDGABRA1
SCHEMBL824419 0.70 NPC1 (0.63) NPC1RAB9AGABRPGABRDGABRA1
SCHEMBL22100054 0.69 NPC1 (0.47) NPC1RAB9AKMT2AKDM4EPDE2A
SCHEMBL17507245 0.67 NPC1 (0.51) NPC1RAB9AGABRPGABRDGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11038137-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2021-06-15 US disclosed
US-10790455-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2020-09-29 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-10790455-B2 Organic electroluminescent materials and devices ORC3, ALKBH2, ENPP3 NPC1 4454/4885RAB9A 2730/4885GABRP 2685/4885
US-11038137-B2 Organic electroluminescent materials and devices ORC3, NUDC, AOC1 NPC1 4373/4885RAB9A 1454/4885GABRP 3171/4885

“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.