SCHEMBL23345012

SCHEMBL23345012

COC(=O)N1CCC(OC)(C(C)(C)C)CC1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 4/20 0.46
USP2 O75604 4/20 0.46
CYP1A2 P05177 4/20 0.46
CYP2D6 P10635 8/20 0.45
CYP3A4 P08684 10/20 0.43
CYP2C19 P33261 6/20 0.43
MEN1 O00255 1/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 1/20 0.43
HSD17B10 Q99714 5/20 0.42
TSHR P16473 4/20 0.41
HIF1A Q16665 2/20 0.41
ALDH1A1 P00352 4/20 0.38

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
SCHEMBL23344999 0.83 CYP1A2 (0.39) CYP2C9USP2CYP1A2CYP2D6CYP3A4
SCHEMBL23995664 0.79 ALDH1A1 (0.37) CYP2C9USP2CYP1A2CYP2D6CYP3A4
SCHEMBL23345013 0.77 HPGD (0.44) MAPK1TSHRALDH1A1
SCHEMBL23345000 0.77 ALDH1A1 (0.49) CYP2C9USP2CYP1A2CYP2D6CYP3A4
SCHEMBL23345230 0.76 CYP4F2 (0.40) CYP2C9USP2CYP1A2CYP2D6CYP3A4
SCHEMBL15451913 0.74 CYP1A2 (0.53) CYP2C9USP2CYP1A2CYP2D6CYP3A4
SCHEMBL31143203 0.73 CYP3A4 (0.49) CYP2C9USP2CYP1A2CYP2D6CYP3A4
SCHEMBL3632294 0.72 CYP1A2 (0.56) CYP2C9USP2CYP1A2CYP2D6CYP3A4
SCHEMBL8603867 0.72
SCHEMBL20617537 0.72 L3MBTL1 (0.53) CYP2C9USP2CYP1A2CYP2D6CYP3A4

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-11168102-B1 Bicyclic heteroaryl compounds and uses thereof Revolution Medicines, Inc. (US) 2021-11-09 US disclosed
US-20210139517-A1 BICYCLIC HETEROARYL COMPOUNDS AND USES THEREOF Revolution Medicines, Inc. 2021-05-13 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-11168102-B1 Bicyclic heteroaryl compounds and uses thereof SOS1, SOST, SOS2 CYP2C9 2750/4885USP2 3363/4885CYP1A2 1997/4885
US-20210139517-A1 BICYCLIC HETEROARYL COMPOUNDS AND USES THEREOF SOST, SOS1, SOS2 CYP2C9 3034/4885USP2 2941/4885CYP1A2 2086/4885

“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.