SCHEMBL29599136

SCHEMBL29599136

Cc1ccccn1.Cc1ccccn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
LMNA P02545 2/20 0.50
CCR1 P32246 2/20 0.50
CCR5 P51681 2/20 0.50
CCR8 P51685 2/20 0.50
CYP1A2 P05177 1/20 0.50
POLB P06746 1/20 0.50
METAP1 P53582 1/20 0.50
BLM P54132 1/20 0.50
HIF1A Q16665 1/20 0.50
DOHH Q9BU89 1/20 0.50
P4HTM Q9NXG6 1/20 0.50
GRM5 P41594 1/20 0.50
NOS3 P29474 2/20 0.46
NOS1 P29475 2/20 0.46
NOS2 P35228 2/20 0.46
NPC1 O15118 2/20 0.46
HSP90AA1 P07900 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
TDP1 Q9NUW8 3/20 0.46

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
SCHEMBL2684 1.00
SCHEMBL29472848 1.00
SCHEMBL16322907 1.00 KDM4E (0.50) KDM4ELMNACCR1CCR5CCR8
SCHEMBL4733426 1.00 KDM4E (0.50) KDM4ELMNACCR1CCR5CCR8
SCHEMBL25382981 0.97
SCHEMBL21274595 0.97
SCHEMBL21528266 0.97
Hydrochloric Acid SCHEMBL21723652 0.97
Ethane SCHEMBL6683700 0.97
Hydrochloric Acid SCHEMBL2333819 0.97

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-117320678-A Phospholipids as anionic chelators in pharmaceutical formulations R·P·谢勒技术有限公司 2023-12-29 CN disclosed
CN-110582503-B Fused bicyclic heterocyclic compound derivatives as pest control agents 拜耳公司 2022-05-31 CN disclosed