SCHEMBL6793293

SCHEMBL6793293

CC1(C(O)c2ccc(-c3ccc(C(=O)NC4CC4)cc3)cc2)NC(=O)NC1=O

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
SMYD3 Q9H7B4 5/20 0.43
HSD11B1 P28845 2/20 0.43
ADAMTS7 Q9UKP4 1/20 0.43
MAPK14 Q16539 6/20 0.42
ROCK2 O75116 1/20 0.41
ROCK1 Q13464 1/20 0.41
BRD4 O60885 1/20 0.40
CREBBP Q92793 1/20 0.40
EZH2 Q15910 1/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2C19 P33261 2/20 0.39
HPGD P15428 1/20 0.39
RAF1 P04049 1/20 0.38
CYP2C9 P11712 1/20 0.38

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
SCHEMBL6840876 0.96 NPC1 (0.45) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL6793526 0.80 CA12 (0.40)
SCHEMBL6791153 0.76 MMP2 (0.41) CYP2C9
SCHEMBL6789361 0.76 MMP2 (0.41) CYP2C9
SCHEMBL6839916 0.75 MMP13 (0.53) SMN1; SMN2MAPK14ROCK2ROCK1CYP2C9
SCHEMBL6790247 0.75 SMN1; SMN2 (0.49) SMN1; SMN2MEN1KMT2ABRD4HPGD
SCHEMBL6797530 0.75 PRMT5 (0.39) SMN1; SMN2
SCHEMBL6798425 0.74 CYP17A1 (0.37) ROCK2ROCK1
SCHEMBL6791748 0.74 NPC1 (0.56) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL6791869 0.73 HSD11B1 (0.44) SMN1; SMN2KMT2AHSD11B1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040147573-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-07-29 US disclosed
US-20040110809-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-06-10 US disclosed
EP-1370536-A1 METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2003-12-17 EP disclosed
EP-1370538-A1 METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2003-12-17 EP disclosed
WO-2002074752-A1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2002-09-26 WO disclosed
WO-2002074750-A1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2002-09-26 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 (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-20040110809-A1 Metalloproteinase inhibitors MMP9, MMP2, MMP3 NPC1 1342/4885RAB9A 1922/4885SMN1; SMN2 3091/4885
US-20040147573-A1 Metalloproteinase inhibitors MMP12, MMP7, MMP10 NPC1 150/4885RAB9A 2385/4885SMN1; SMN2 2809/4885

“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.