SCHEMBL29979558

SCHEMBL29979558

CC(C)(C)OC(=O)N[C@H]1CCCN(C(=O)c2ccccc2)C1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.60
CA2 P00918 1/20 0.60
USP30 Q70CQ3 2/20 0.60
NPC1L1 Q9UHC9 2/20 0.56
NAMPT P43490 1/20 0.53
PADI4 Q9UM07 3/20 0.51
KMT2A Q03164 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
PARP1 P09874 1/20 0.48
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
HPGD P15428 1/20 0.47
HIF1A Q16665 1/20 0.47
MEN1 O00255 1/20 0.47
EPHX2 P34913 1/20 0.47
EPHX1 P07099 1/20 0.47
BTK Q06187 1/20 0.47
KDM1A O60341 1/20 0.46
MAOB P27338 1/20 0.46

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
SCHEMBL24812983 1.00 CA1 (0.60) CA1CA2USP30NPC1L1NAMPT
SCHEMBL25741350 1.00 CA1 (0.60) CA1CA2USP30NPC1L1NAMPT
SCHEMBL4703541 0.96 USP30 (0.56) CA1CA2USP30NPC1L1NAMPT
SCHEMBL2610266 0.93 NAMPT (0.61) CA1CA2USP30NPC1L1NAMPT
SCHEMBL7939466 0.93 NAMPT (0.61) CA1CA2USP30NPC1L1NAMPT
SCHEMBL3317089 0.89 CA1 (0.59) CA1CA2USP30NPC1L1NAMPT
SCHEMBL3317093 0.89 CA1 (0.59) CA1CA2USP30NPC1L1NAMPT
SCHEMBL3320831 0.88 CA1 (0.58) CA1CA2USP30NPC1L1NAMPT
SCHEMBL3320824 0.88 CA1 (0.58) CA1CA2USP30NPC1L1NAMPT
SCHEMBL8298895 0.87 NAMPT (0.54) CA1CA2USP30NPC1L1NAMPT

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12065445-B2 CDK2 inhibitors and methods of using the same CEDILLA THERAPEUTICS, INC. (US) 2024-08-20 US disclosed
US-20240174680-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2024-05-30 US disclosed
EP-4284365-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME Cedilla Therapeutics, Inc. (US) 2023-12-06 EP disclosed
US-20230109076-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. 2023-04-06 US disclosed
WO-2022165513-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2022-08-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240174680-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CDK2, CDK20, CDK2AP2 CA1 3740/4885CA2 3554/4885USP30 1431/4885
US-20230109076-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CDK2, CDK20, CDK2AP2 CA1 3740/4885CA2 3554/4885USP30 1431/4885
US-12065445-B2 CDK2 inhibitors and methods of using the same CDK2, CDK20, CDK1 CA1 2850/4885CA2 1979/4885USP30 1983/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.