SCHEMBL7930215

SCHEMBL7930215

CC(Sc1ccccc1)C1CCCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 5/20 0.51
GPR119 Q8TDV5 3/20 0.47
HPGDS O60760 2/20 0.46
ACKR3 P25106 1/20 0.45
PRMT5 O14744 1/20 0.44
WDR77 Q9BQA1 1/20 0.44
ALDH1A1 P00352 2/20 0.43
MAPT P10636 2/20 0.43
NPC1 O15118 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43
KDM4E B2RXH2 1/20 0.42
PKM P14618 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL7921625 0.88 GPR119 (0.48) USP30GPR119ACKR3PRMT5WDR77
SCHEMBL2190031 0.85 USP30 (0.45) USP30GPR119MAPTKMT2A
SCHEMBL970901 0.81 USP30 (0.53) USP30GPR119HPGDSACKR3PRMT5
SCHEMBL3325433 0.81 USP30 (0.53) USP30GPR119HPGDSACKR3PRMT5
SCHEMBL970900 0.81 USP30 (0.53) USP30GPR119HPGDSACKR3PRMT5
SCHEMBL970903 0.81 USP30 (0.53) USP30GPR119HPGDSACKR3PRMT5
SCHEMBL12631529 0.81 USP30 (0.53) USP30GPR119HPGDSACKR3PRMT5
SCHEMBL3325441 0.81 USP30 (0.53) USP30GPR119HPGDSACKR3PRMT5
SCHEMBL3325435 0.81 USP30 (0.53) USP30GPR119HPGDSACKR3PRMT5
SCHEMBL18325517 0.81 USP30 (0.52) USP30GPR119HPGDSACKR3PRMT5

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-20110172236-A1 SUBSTITUTED ARYL SULFONE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS CHAKRAVARTY PRASUN K 2011-07-14 US disclosed
WO-2010036589-A1 SUBSTITUTED ARYL SULFONE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS MERCK SHARP & DOHME CORP. (US) 2010-04-01 WO 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-20110172236-A1 SUBSTITUTED ARYL SULFONE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS TRPV1, TRPA1, CACNA1D USP30 3244/4885GPR119 136/4885HPGDS 1287/4885

“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.