SCHEMBL29079633

SCHEMBL29079633

Cc1n[nH]c2nccc(Br)c12

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.40
DAO P14920 1/20 0.38
LRRK2 Q5S007 4/20 0.33
AXL P30530 1/20 0.32
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PDPK1 O15530 1/20 0.31
MAPK1 P28482 1/20 0.31
CHEK1 O14757 1/20 0.30

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
SCHEMBL29767999 1.00 PRKCI (0.40) PRKCIDAOLRRK2AXLMAPT
SCHEMBL25245801 0.80 PRKCI (0.42) PRKCIDAOAXLPDPK1MAPK1
SCHEMBL15890593 0.80 LRRK2 (0.36) LRRK2SMN1; SMN2
SCHEMBL26720427 0.77 PRKCI (0.40) PRKCIDAOAXLPDPK1MAPK1
SCHEMBL2693931 0.77 LRRK2 (0.41) PRKCIDAOLRRK2AXLMAPT
SCHEMBL29514134 0.77 LRRK2 (0.41) PRKCIDAOLRRK2AXLMAPT
SCHEMBL30406195 0.77 LRRK2 (0.33) LRRK2PDPK1CHEK1
SCHEMBL2675683 0.77 LRRK2 (0.33) LRRK2PDPK1CHEK1
SCHEMBL1585572 0.77 PRKCI (0.40) PRKCIDAOAXLMAPTPDPK1
SCHEMBL30332332 0.77 DAO (0.39) PRKCIDAOLRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116648248-B Aromatic compound, pharmaceutical composition containing same and application thereof 成都茵创园医药科技有限公司 2025-04-15 CN disclosed
CN-116648248-A Aromatic compound, pharmaceutical composition containing same and application thereof 成都茵创园医药科技有限公司 2023-08-25 CN disclosed
WO-2022161414-A1 AROMATIC COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND APPLICATION THEREOF 成都茵创园医药科技有限公司 2022-08-04 WO disclosed