SCHEMBL4092570

SCHEMBL4092570

CC(C)(C(=O)NC1CC1)c1ccc(Cl)s1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
NPC1 O15118 5/20 0.37
SSTR4 P31391 3/20 0.36
LMNA P02545 2/20 0.36
HSD11B1 P28845 2/20 0.36
SSTR1 P30872 2/20 0.36
F10 P00742 1/20 0.36
PPARA Q07869 1/20 0.36
P2RX7 Q99572 1/20 0.35
NPSR1 Q6W5P4 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
SCHEMBL4094266 0.74 RAB9A (0.47) RAB9AKMT2AMEN1GAASMN1; SMN2
SCHEMBL25464169 0.73 LMNA (0.50) RAB9AKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL9037642 0.72 F2 (0.48) RAB9AKMT2AGAAHTTSMN1; SMN2
SCHEMBL25907323 0.68 CHRM3 (0.39) LMNA
SCHEMBL10169456 0.68 EPHX2 (0.48) RAB9AKMT2AMEN1HTTSMN1; SMN2
SCHEMBL4242263 0.68 SMN1; SMN2 (0.35) RAB9AKMT2AMEN1GAAHTT
SCHEMBL25464213 0.67 NPC1 (0.49) RAB9AKMT2AMEN1GAAHTT
SCHEMBL3143316 0.67 EPHX1 (0.55) RAB9AKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL27749355 0.67 PPARA (0.42) RAB9AKMT2AMEN1GAAHTT
SCHEMBL25464172 0.66 SSTR4 (0.44) RAB9AKMT2AALDH1A1NPC1SSTR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101400660-A Triazole derivative or salt thereof ASTELLAS PHARMA INC (JP) 2009-04-01 CN disclosed
US-20090082367-A1 TRIAZOLE DERIVATIVE OR A SALT THEREOF ASTELLAS PHARMA INC. (JP) 2009-03-26 US disclosed
EP-1995243-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF Astellas Pharma Inc. (JP) 2008-11-26 EP 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-20090082367-A1 TRIAZOLE DERIVATIVE OR A SALT THEREOF HSD11B1, HSD11B2, HSD17B1 RAB9A 3659/4885KMT2A 1938/4885MEN1 2335/4885

“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.