SCHEMBL16746145

SCHEMBL16746145

CC(C)c1ccc2c(c1C(C)C)NC(=O)CS2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.41
MAOA P21397 3/20 0.38
MAOB P27338 3/20 0.38
HTT P42858 1/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
TDP1 Q9NUW8 2/20 0.36
GAA P10253 2/20 0.36
KMT2A Q03164 2/20 0.36
HPGD P15428 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
RECQL P46063 1/20 0.36
BLM P54132 1/20 0.36
HSD17B10 Q99714 1/20 0.36
USP2 O75604 1/20 0.34
ATM Q13315 1/20 0.33

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
SCHEMBL16746146 0.75 EPHX2 (0.44) EPHX2MAOAMAOBHTTALDH1A1
SCHEMBL16746089 0.71 NPC1 (0.37) MAOAMAOBKDM4E
SCHEMBL16746094 0.71 MEN1 (0.36) ALDH1A1GAAKMT2AMEN1
SCHEMBL16746087 0.70 XIAP (0.33)
SCHEMBL16746136 0.70 XIAP (0.36) EPHX2
SCHEMBL16746129 0.69 MMP12 (0.43) ALDH1A1LMNAKMT2AMAPT
SCHEMBL9918342 0.67 HTT (0.55) EPHX2MAOAMAOBHTTALDH1A1
SCHEMBL20710540 0.66 EPHX2 (0.47) EPHX2MAOAMAOBHTTALDH1A1
SCHEMBL13306180 0.66 PDE3B (0.46) EPHX2MAOAMAOBHTTALDH1A1
SCHEMBL15586614 0.65 EPHX2 (0.63) EPHX2MAOAMAOBHTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9918990-B2 Substituted pyrrolo[2,3-c]pyridines and pyrazolo[3,4-c]pyridines as BET protein inhibitors INCYTE CORPORATION (US) 2018-03-20 US disclosed
US-20170014418-A1 BICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS INCYTE CORPORATION 2017-01-19 US disclosed
US-9399640-B2 Substituted pyrrolo[2,3-c]pyridines and pyrazolo[3,4-c]pyridines as BET protein inhibitors INCYTE CORPORATION (US) 2016-07-26 US disclosed
US-20150148372-A1 BICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS INCYTE CORPORATION (US) 2015-05-28 US disclosed
US-20150148342-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 (3 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-20150148372-A1 BICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS BRD1, BRD3, BRD2 EPHX2 3235/4885MAOA 4575/4885MAOB 3742/4885
US-20170014418-A1 BICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS BRD1, BRD3, BRD2 EPHX2 3235/4885MAOA 4575/4885MAOB 3742/4885
US-20150148342-A1 BICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS BRD1, BRD3, BRD2 EPHX2 3235/4885MAOA 4575/4885MAOB 3742/4885

“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.