SCHEMBL16744209

SCHEMBL16744209

CC(C)c1cc2c(cc1C(C)C)SCCN2

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 1/20 0.44
INMT O95050 1/20 0.35
RYR2 Q92736 1/20 0.34

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
SCHEMBL16744219 0.77 KDM4E (0.35) MEN1GAAKMT2A
SCHEMBL12424583 0.77 CA1 (0.33)
SCHEMBL24654710 0.77 ALDH1A1 (0.49) MEN1ALDH1A1GAAKMT2ARYR2
SCHEMBL15691802 0.74 MEN1 (0.48) MEN1ALDH1A1GAAKMT2AINMT
SCHEMBL22627563 0.69 MEN1 (0.45) MEN1ALDH1A1GAAKMT2ARYR2
SCHEMBL10226479 0.69 GAA (0.53) MEN1ALDH1A1GAAKMT2ARYR2
SCHEMBL19705380 0.69 MEN1 (0.44) MEN1ALDH1A1GAAKMT2AINMT
SCHEMBL1615688 0.68 DRD2 (0.42) ALDH1A1GAA
SCHEMBL16746094 0.68 MEN1 (0.36) MEN1ALDH1A1GAAKMT2AINMT
SCHEMBL16746090 0.68 MEN1 (0.36) MEN1ALDH1A1GAAKMT2AINMT

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-9737516-B2 Bicyclic heterocycles as bet protein inhibitors INCYTE CORPORATION (US) 2017-08-22 US disclosed
US-20160213654-A1 BICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS INCYTE CORPORATION 2016-07-28 US disclosed
US-9315501-B2 Bicyclic heterocycles as BET protein inhibitors INCYTE CORPORATION (US) 2016-04-19 US disclosed
US-20150148375-A1 BICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS INCYTE CORPORATION (US) 2015-05-28 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-20150148375-A1 BICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS BRD1, BRD3, BRD2 MEN1 2146/4885ALDH1A1 4585/4885GAA 4778/4885
US-20160213654-A1 BICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS BRD1, BRD3, BRD2 MEN1 2146/4885ALDH1A1 4585/4885GAA 4778/4885

“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.