SCHEMBL31528302

SCHEMBL31528302

COc1ccc(CN(Cc2ccc(OC)cc2)c2ncnn3ccnc23)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.44
▸ MAPT P10636 2/20 0.44
▸ ALDH1A1 P00352 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ CYP1A2 P05177 2/20 0.41
▸ CYP2D6 P10635 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ CHRM2 P08172 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ HTR1A P08908 1/20 0.41
▸ ADRA2A P08913 1/20 0.41
▸ DRD1 P21728 1/20 0.41
▸ HTR2A P28223 1/20 0.41
▸ HTR2C P28335 1/20 0.41
▸ SLC6A4 P31645 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ HRH1 P35367 1/20 0.41
▸ OPRM1 P35372 1/20 0.41
▸ HTR2B P41595 1/20 0.41

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
SCHEMBL31528231 0.82 TSHR (0.39) LMNAMAPTALDH1A1MEN1CYP1A2
SCHEMBL30778157 0.79 LMNA (0.41) LMNAMAPTALDH1A1MEN1CYP1A2
SCHEMBL25250333 0.76 SMN1; SMN2 (0.40) LMNAMAPTALDH1A1MEN1CYP1A2
SCHEMBL25218808 0.76 LMNA (0.42) LMNAMAPTALDH1A1MEN1CYP1A2
SCHEMBL25250318 0.76 LMNA (0.39) LMNAMAPTALDH1A1MEN1CYP1A2
SCHEMBL19354353 0.75 PDE1B (0.44) LMNAMAPTALDH1A1MEN1KMT2A
SCHEMBL21199702 0.75 LMNA (0.38) LMNAMAPTALDH1A1MEN1CYP1A2
SCHEMBL25206909 0.75 LMNA (0.41) LMNAMAPTALDH1A1MEN1CYP1A2
SCHEMBL29921950 0.74 CCNB2 (0.50) LMNAMAPTMEN1KMT2AKDM4E
SCHEMBL27164615 0.74 LMNA (0.37) LMNAMAPTALDH1A1MEN1CYP1A2

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-113423708-B Imidazo [2,1-F ] [1,2,4] triazin-4-amine derivatives as TLR7 agonists 百济神州有限公司 2025-04-22 — — CN disclosed
CN-113454086-B Imidazo [2,1-F ] [1,2,4] triazin-4-amine derivatives as TLR7 agonists 百济神州有限公司 2025-03-14 — — CN disclosed
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