SCHEMBL29211325

SCHEMBL29211325

c1ccc2c(c1)nnc1nnnnc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 3/20 0.54
▸ LMNA P02545 3/20 0.39
▸ HTT P42858 2/20 0.39
▸ CYP1A2 P05177 2/20 0.38
▸ CYP2C19 P33261 2/20 0.38
▸ LCK P06239 1/20 0.35
▸ MAP2K3 P46734 1/20 0.35
▸ MAP2K6 P52564 1/20 0.35
▸ BTK Q06187 1/20 0.35
▸ MAP3K19 Q56UN5 1/20 0.35
▸ NEK10 Q6ZWH5 1/20 0.35
▸ KDM1A O60341 1/20 0.32
▸ KDM4E B2RXH2 5/20 0.32
▸ ALDH1A1 P00352 4/20 0.32
▸ SMN1; SMN2 Q16637 4/20 0.32
▸ MAOA P21397 2/20 0.32
▸ GLA P06280 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ CASP1 P29466 2/20 0.32
▸ CASP7 P55210 2/20 0.32

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
SCHEMBL3182569 0.98 GPR3 (0.52) GPR3LMNAHTTCYP1A2CYP2C19
SCHEMBL29211321 0.77 KDM4E (0.43) LMNAHTTKDM4EALDH1A1SMN1; SMN2
Benzonaphthyridine SCHEMBL30897319 0.72 GPR3 (1.00) GPR3LMNAHTTCYP1A2CYP2C19
Benzonaphthyridine SCHEMBL51197 0.72 GPR3 (1.00) GPR3LMNAHTTCYP1A2CYP2C19
Benzonaphthyridine SCHEMBL29600756 0.72 GPR3 (1.00) GPR3LMNAHTTCYP1A2CYP2C19
SCHEMBL2680851 0.68 ALDH1A1 (0.46) GPR3LMNAHTTCYP1A2CYP2C19
SCHEMBL10820343 0.67 GPR3 (0.65) GPR3LMNAHTTCYP1A2CYP2C19
SCHEMBL4485428 0.67 GPR3 (0.87) GPR3LMNAHTTCYP1A2CYP2C19
SCHEMBL29211322 0.67 KDM4E (0.45) GPR3LMNACYP1A2KDM4EALDH1A1
SCHEMBL11199602 0.67 GPR3 (0.56) GPR3LMNAHTTKDM4EALDH1A1

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
CN-117998881-A Light emitting device, light emitting apparatus, electronic device, and lighting apparatus 株式会社半导体能源研究所 2024-05-07 — — CN disclosed
CN-117998880-A Light emitting device 株式会社半导体能源研究所 2024-05-07 — — CN disclosed
Send feedback