SCHEMBL30157508

SCHEMBL30157508

O=C(CC1CCC(=O)N1Cc1ccc(Cl)nc1)NC1CC1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ P2RX7 Q99572 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ HTT P42858 1/20 0.37

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
SCHEMBL30158432 0.85 KMT2A (0.43) KMT2AMEN1ATMHDAC1HDAC2
SCHEMBL30158019 0.84 KMT2A (0.40) KMT2AMEN1ATMHDAC1HDAC2
SCHEMBL30157712 0.83 KMT2A (0.57) KMT2AATMCYP3A4CYP2C9CYP2C19
SCHEMBL30157807 0.83 TSHR (0.47) LMNAKMT2AMEN1HDAC1HDAC2
SCHEMBL30158819 0.82 KMT2A (0.43) LMNAKMT2AMEN1HDAC1HDAC2
SCHEMBL30158617 0.82 SLC6A4 (0.46) KMT2AMEN1HDAC1HDAC2CYP3A4
SCHEMBL30158714 0.81 KMT2A (0.56) KMT2AMEN1HDAC1HDAC2CYP3A4
SCHEMBL30157771 0.80 HDAC1 (0.37) KMT2AMEN1ATMHDAC1HDAC2
SCHEMBL30157408 0.78 SIGMAR1 (0.51) LMNAKMT2AHDAC1HDAC2ALDH1A1
SCHEMBL30157737 0.77 EPHX2 (0.56) KMT2AMEN1ALDH1A1

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
WO-2022268520-A1 USE OF SUBSTITUTED PYRROLIDINONES OR THEIR SALTS FOR INCREASING STRESS TOLERANCE OF PLANTS BAYER AKTIENGESELLSCHAFT (DE) 2022-12-29 — — WO disclosed
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