SCHEMBL10069335

SCHEMBL10069335

CCOC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSK P43235 4/20 0.62
CTSS P25774 2/20 0.62
CYP1A2 P05177 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
HTT P42858 1/20 0.52
AAK1 Q2M2I8 2/20 0.47
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CACNA1B Q00975 5/20 0.43
ALDH1A1 P00352 3/20 0.43
MAPT P10636 3/20 0.43
METAP2 P50579 1/20 0.42
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
ALOX12 P18054 1/20 0.40

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
SCHEMBL13337661 0.96 CTSK (0.57) CTSKCTSSCYP1A2CYP2C9CYP2C19
SCHEMBL23118362 0.89 CTSK (0.65) CTSKCTSSAAK1HDAC4HDAC1
SCHEMBL1424546 0.89 CTSK (0.65) CTSKCTSSAAK1HDAC4HDAC1
SCHEMBL21427217 0.89 CTSK (0.65) CTSKCTSSAAK1HDAC4HDAC1
SCHEMBL21119399 0.89 CTSK (0.65) CTSKCTSSAAK1HDAC4HDAC1
SCHEMBL5063217 0.89 CTSK (0.65) CTSKCTSSAAK1HDAC4HDAC1
SCHEMBL29780434 0.88 CTSK (0.55) CTSKCTSSCYP1A2CYP2C9CYP2C19
SCHEMBL4576713 0.87 CTSK (0.63) CTSKCTSSCYP1A2CYP2C9CYP2C19
SCHEMBL19385461 0.87 CTSK (0.63) CTSKCTSSCYP1A2CYP2C9CYP2C19
SCHEMBL4576704 0.87 CTSK (0.63) CTSKCTSSCYP1A2CYP2C9CYP2C19

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-2025034093-A1 PPM1D DEGRADATION-INDUCING COMPOUND AND USE THEREOF (주)노보메디슨 2025-02-13 WO disclosed
WO-2012019428-A1 BENZOHYDROL DERIVATIVES, A PREPARATION PROCESS AND PHARMACEUTICAL USE THEREOF 上海恒瑞医药有限公司 (CN) 2012-02-16 WO disclosed