SCHEMBL29136432

SCHEMBL29136432

[CH2]c1cnn(C)c(=O)c1Cl

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KAT2B Q92831 13/20 0.56
▸ BRD9 Q9H8M2 5/20 0.56
▸ BRD4 O60885 7/20 0.47
▸ BPTF Q12830 5/20 0.47
▸ MAPT P10636 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL979278 0.78 KAT2B (0.60) KAT2BBRD9BRD4BPTFMAPT
SCHEMBL14074017 0.77 KAT2B (0.58) KAT2BBRD9BRD4BPTFMAPT
Hydrochloric Acid SCHEMBL17912386 0.77 KAT2B (0.58) KAT2BBRD9BRD4BPTFMAPT
SCHEMBL7010722 0.75 KAT2B (0.56) KAT2BBRD9BRD4BPTFMAPT
SCHEMBL12160455 0.75 KAT2B (0.56) KAT2BBRD9BRD4BPTFMAPT
SCHEMBL23755064 0.75 KAT2B (0.56) KAT2BBRD9BRD4BPTFMAPT
SCHEMBL17912364 0.75 KAT2B (0.56) KAT2BBRD9BRD4BPTFMAPT
SCHEMBL8282652 0.73 KAT2B (0.55) KAT2BBRD9BRD4BPTFMAPT
SCHEMBL7553663 0.73 — —
SCHEMBL2544338 0.72 RAB9A (0.55) KAT2BBRD9BRD4BPTFMAPT

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-117120440-A TYK2 inhibitor and application thereof 苏多生物科学有限公司 2023-11-24 — — CN disclosed
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