SCHEMBL3023830

SCHEMBL3023830

CC(C)(C)OC(=O)N1C[C@@H]2OCc3c(O)cccc3[C@@H]2C1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.43
KDM4E B2RXH2 1/20 0.40
PDE4B Q07343 5/20 0.40
NAMPT P43490 1/20 0.39
HSD11B1 P28845 2/20 0.39
TERT O14746 1/20 0.39
DDB1 Q16531 1/20 0.37
CRBN Q96SW2 1/20 0.37
USP30 Q70CQ3 1/20 0.37
NR1H2 P55055 1/20 0.37
TACR1 P25103 1/20 0.36
GPR119 Q8TDV5 1/20 0.36

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
SCHEMBL3024378 1.00 RORC (0.43) RORCKDM4EPDE4BNAMPTHSD11B1
SCHEMBL3023828 1.00 RORC (0.43) RORCKDM4EPDE4BNAMPTHSD11B1
SCHEMBL3027132 0.88 RORC (0.43) RORCKDM4EPDE4BNAMPTDDB1
SCHEMBL3027134 0.88 RORC (0.43) RORCKDM4EPDE4BNAMPTDDB1
SCHEMBL3018279 0.87 PDE4B (0.47) RORCKDM4EPDE4BNAMPT
SCHEMBL3018278 0.87 PDE4B (0.47) RORCKDM4EPDE4BNAMPT
SCHEMBL3023568 0.86 RORC (0.41) RORCKDM4EPDE4BNAMPTDDB1
SCHEMBL3025951 0.86 KDM4E (0.43) RORCKDM4EPDE4BNAMPTDDB1
SCHEMBL3025953 0.86 KDM4E (0.43) RORCKDM4EPDE4BNAMPTDDB1
SCHEMBL3023565 0.86 RORC (0.41) RORCKDM4EPDE4BNAMPTDDB1

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
US-20100210680-A1 TRICYCLIC HETEROCYCLIC DERIVATIVES N.V. ORGANON 2010-08-19 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 (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-20100210680-A1 TRICYCLIC HETEROCYCLIC DERIVATIVES TPH1, HTR2C, TPH2 RORC 1536/4885KDM4E 2053/4885PDE4B 773/4885

“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.