SCHEMBL28210873

SCHEMBL28210873

[CH2]c1cccc2c1C(CC)CN2

nearest known ligand 0.41

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 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
SCHEMBL28858606 0.79 HTR2A (0.32) —
SCHEMBL1118519 0.74 CCKBR (0.42) —
SCHEMBL12141050 0.74 CCKBR (0.42) —
SCHEMBL12013752 0.74 CCKBR (0.42) —
SCHEMBL16684950 0.71 DRD2 (0.41) —
SCHEMBL13498507 0.67 CYP1A2 (0.33) —
Fluorobenzene SCHEMBL27513190 0.67 CCKBR (0.40) —
SCHEMBL10081660 0.67 GSK3B (0.36) —
SCHEMBL13261553 0.67 CHRNB2 (0.40) —
SCHEMBL8325427 0.66 LRRK2 (0.33) LRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107873030-A 5‑HT2CReceptor agonists and compositions and methods of use 艾尼纳制药公司 2018-04-03 — — CN disclosed
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