SCHEMBL30610285

SCHEMBL30610285

Cc1ccc(-c2ccccn2)cc1Br

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.47
KDM4E B2RXH2 2/20 0.47
MEN1 O00255 2/20 0.47
TP53 P04637 2/20 0.47
PKM P14618 2/20 0.47
KMT2A Q03164 2/20 0.47
MAPT P10636 2/20 0.47
RAB9A P51151 2/20 0.47
TSHR P16473 1/20 0.47
CYP1A2 P05177 2/20 0.45
METAP1 P53582 2/20 0.45
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
CCR1 P32246 1/20 0.45
CCR5 P51681 1/20 0.45
CCR8 P51685 1/20 0.45
BLM P54132 1/20 0.45
HIF1A Q16665 1/20 0.45
DOHH Q9BU89 1/20 0.45
P4HTM Q9NXG6 1/20 0.45

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
SCHEMBL23525622 1.00 NPC1 (0.47) NPC1KDM4EMEN1TP53PKM
SCHEMBL29327551 0.92 NPC1 (0.42) NPC1KDM4EMEN1TP53PKM
SCHEMBL28129414 0.83 KDM4E (0.50) NPC1KDM4ETP53PKMMAPT
SCHEMBL7662434 0.83 KDM4E (0.56) NPC1KDM4EMEN1TP53PKM
SCHEMBL21022955 0.80 NPC1 (0.49) NPC1KDM4EMEN1TP53PKM
SCHEMBL19794343 0.79 PDK2 (0.45) NPC1KDM4EMEN1TP53PKM
SCHEMBL23525612 0.79 RET (0.50) NPC1KDM4EMEN1TP53PKM
SCHEMBL16792550 0.79 TSHR (0.55) NPC1KDM4EMEN1TP53PKM
SCHEMBL23253142 0.79 KDM4E (0.50) NPC1KDM4EMEN1TP53PKM
SCHEMBL16456554 0.79 NPC1 (0.65) NPC1KDM4EMEN1TP53PKM

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-117279468-A Phosphorescent excimer with preferred molecular orientation as monochromatic emitter for display and illumination applications 李健 2023-12-22 CN disclosed
CN-111527615-B Phosphorescent excimer with preferred molecular orientation as monochromatic emitter for display and illumination applications 李健 2023-10-17 CN disclosed