SCHEMBL21166397

SCHEMBL21166397

CCC(C)(CC)CNC(=O)[C@H](C)Cl

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.31
USP2 O75604 1/20 0.30
TSHR P16473 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
SCHEMBL24690398 0.89 TSHR (0.35) TSHR
SCHEMBL19069195 0.86 EPHX1 (0.32)
SCHEMBL18737456 0.86 EPHX1 (0.32)
SCHEMBL13575309 0.84 SMN1; SMN2 (0.32) L3MBTL1USP2TSHR
SCHEMBL13575316 0.84 SMN1; SMN2 (0.32) L3MBTL1USP2TSHR
SCHEMBL12313005 0.84 SMN1; SMN2 (0.32) L3MBTL1USP2TSHR
SCHEMBL9004533 0.81 MMP1 (0.35) L3MBTL1
SCHEMBL9004535 0.81 MMP1 (0.35) L3MBTL1
SCHEMBL9004534 0.81 MMP1 (0.35) L3MBTL1
SCHEMBL20987710 0.79 TSHR (0.33) TSHR

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
US-10618902-B2 Substituted pyrido[2,3-d]pyrimidines as inhibitors of protein kinases CELGENE CAR LLC (BM) 2020-04-14 US disclosed
US-20190218220-A1 HETEROARYL COMPOUNDS AND USES THEREOF BRISTOL-MYERS SQUIBB COMPANY 2019-07-18 US 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 (2 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-20190218220-A1 HETEROARYL COMPOUNDS AND USES THEREOF PRKACA, PRKDC, AURKC L3MBTL1 2470/4885USP2 1749/4885TSHR 4378/4885
US-10618902-B2 Substituted pyrido[2,3-d]pyrimidines as inhibitors of protein kinases PDXK, DCK, DTYMK L3MBTL1 3277/4885USP2 2380/4885TSHR 3723/4885

“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.