SCHEMBL30612343

SCHEMBL30612343

OCC1CCN(c2ccc(I)cn2)C1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 11/20 0.46
▸ MAP4K4 O95819 1/20 0.43
▸ PTGER4 P35408 1/20 0.39
▸ FPR1 P21462 1/20 0.39
▸ FPR2 P25090 1/20 0.39
▸ KLKB1 P03952 1/20 0.38
▸ KLK1 P06870 1/20 0.38

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
SCHEMBL24735417 1.00 PDE10A (0.46) PDE10AMAP4K4PTGER4FPR1FPR2
SCHEMBL24735586 1.00 PDE10A (0.46) PDE10AMAP4K4PTGER4FPR1FPR2
SCHEMBL29841524 1.00 PDE10A (0.46) PDE10AMAP4K4PTGER4FPR1FPR2
SCHEMBL24735424 1.00 PDE10A (0.46) PDE10AMAP4K4PTGER4FPR1FPR2
SCHEMBL30612346 0.91 PDE10A (0.48) PDE10A
SCHEMBL24735175 0.91 PDE10A (0.48) PDE10A
SCHEMBL30612361 0.88 PDE10A (0.41) PDE10AMAP4K4
SCHEMBL24735600 0.88 PDE10A (0.41) PDE10AMAP4K4
SCHEMBL18391586 0.85 PDE10A (0.39) PDE10AMAP4K4
SCHEMBL15652803 0.82 MAP4K4 (0.48) PDE10AMAP4K4PTGER4FPR1FPR2

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-117042769-A Substituted pyrrolopyrimidines and pyrazolopyrimidines as Bruton's Tyrosine Kinase (BTK) degrading agents 冰洲石生物科技公司 2023-11-10 — — CN disclosed
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