SCHEMBL26699652

SCHEMBL26699652

CC(C)P(=O)(c1ccc(CN)cc1)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.41
PSIP1 O75475 1/20 0.39
LOXL2 Q9Y4K0 6/20 0.39
ANPEP P15144 1/20 0.39
ERAP2 Q6P179 1/20 0.39
HDAC3 O15379 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
NCOR2 Q9Y618 1/20 0.38
ABAT P80404 1/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA12 O43570 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
CA5A P35218 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CA5B Q9Y2D0 1/20 0.38
MAPT P10636 1/20 0.36

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
SCHEMBL18539752 0.76 HRH3 (0.46) HRH3PSIP1LOXL2ANPEPERAP2
SCHEMBL30671484 0.72 CPB2 (0.34) HRH3PSIP1LOXL2ANPEPERAP2
SCHEMBL24899769 0.71 CYP1A2 (0.32) CA1CA2
SCHEMBL18860664 0.71 CYP2A6 (0.38) CA12CA9CA14SMN1; SMN2
SCHEMBL13538144 0.71 CA2 (0.48) HRH3LOXL2ANPEPERAP2HDAC3
SCHEMBL14182391 0.70 ALDH1A1 (0.52) CA2CA4CA5AMAPT
Hydrochloric Acid SCHEMBL22165294 0.70 CA2 (0.46) HRH3LOXL2ANPEPERAP2HDAC3
SCHEMBL28858779 0.69 PSIP1 (0.42) HRH3PSIP1LOXL2ANPEPERAP2
SCHEMBL2582095 0.68 ADRA2B (0.42) HRH3PSIP1LOXL2ABATCA1
SCHEMBL31019757 0.68 LOXL2 (0.39) HRH3PSIP1LOXL2ANPEPERAP2

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
WO-2023226950-A1 PEPTIDOMIMETIC STAT PROTEIN DEGRADER, COMPOSITION AND USE THEREOF 杭州和正医药有限公司 2023-11-30 WO disclosed
CN-117126231-A Peptoid STAT protein degradation agent, composition and application thereof 杭州和正医药有限公司 2023-11-28 CN disclosed