SCHEMBL30669043

SCHEMBL30669043

CC(F)[C@@H]1COC(C)(C)N1C(=O)OC(C)(C)C

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 1/20 0.46
BRD4 O60885 1/20 0.37
CHRM2 P08172 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
USP2 O75604 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HCRTR2 O43614 1/20 0.32
PREP P48147 1/20 0.31
HSD11B2 P80365 1/20 0.31
RECQL P46063 1/20 0.31
CCR2 P41597 1/20 0.30
NR1H2 P55055 1/20 0.30

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
SCHEMBL12396343 0.88 SPHK1 (0.50) SPHK1BRD4CHRM2CHRM1CHRM3
SCHEMBL18878400 0.88 SPHK1 (0.50) SPHK1BRD4CHRM2CHRM1CHRM3
SCHEMBL30669036 0.87 SPHK1 (0.46) SPHK1BRD4CHRM2CHRM1CHRM3
SCHEMBL16553345 0.87 SPHK1 (0.46) SPHK1BRD4CHRM2CHRM1CHRM3
SCHEMBL15336587 0.87 SPHK1 (0.46) SPHK1BRD4CHRM2CHRM1CHRM3
SCHEMBL16553346 0.87 SPHK1 (0.46) SPHK1BRD4CHRM2CHRM1CHRM3
SCHEMBL15925967 0.85 SPHK1 (0.48) SPHK1BRD4CHRM2CHRM1CHRM3
SCHEMBL30170046 0.84 SPHK1 (0.45) SPHK1BRD4CHRM2CHRM1CHRM3
SCHEMBL2615737 0.84 SPHK1 (0.47) SPHK1BRD4CHRM2CHRM1CHRM3
SCHEMBL3962686 0.84 SPHK1 (0.42) SPHK1BRD4CHRM2CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250346592-A1 HETEROCYCLIC PAD4 INHIBITORS CELGENE CORPORATION 2025-11-13 US disclosed
EP-4531849-A1 HETEROCYCLIC PAD4 INHIBITORS CELGENE CORPORATION (US) 2025-04-09 EP disclosed
CN-119604287-A Heterocyclic PAD4 inhibitors 细胞基因公司 2025-03-11 CN disclosed
WO-2023230609-A1 HETEROCYCLIC PAD4 INHIBITORS CELGENE CORPORATION (US) 2023-11-30 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 (1 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-20250346592-A1 HETEROCYCLIC PAD4 INHIBITORS PADI4, PADI6, PADI2 SPHK1 4085/4885BRD4 180/4885CHRM2 3580/4885

“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.