SCHEMBL3761296

SCHEMBL3761296

CCN1C(=O)OCC1Cc1ccc(Oc2ccc(C=C3SC(=S)NC3=O)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 2/20 0.53
MMP13 P45452 2/20 0.53
RAB9A P51151 3/20 0.53
NPC1 O15118 1/20 0.53
MYC P01106 1/20 0.53
MAX P61244 1/20 0.53
CSNK2A2 P19784 1/20 0.50
CLK1 P49759 1/20 0.50
CSNK2B P67870 1/20 0.50
CSNK2A1 P68400 1/20 0.50
DYRK1A Q13627 1/20 0.50
DYRK1B Q9Y463 1/20 0.50
MEN1 O00255 2/20 0.49
POLB P06746 2/20 0.49
KMT2A Q03164 2/20 0.49
GPR35 Q9HC97 1/20 0.49
PIK3CG P48736 1/20 0.46
CTSD P07339 3/20 0.46
ADAMTS5 Q9UNA0 2/20 0.46
PDE4B Q07343 1/20 0.45

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
SCHEMBL12997315 1.00 MMP3 (0.53) MMP3MMP13RAB9ANPC1MYC
SCHEMBL3761292 1.00 MMP3 (0.53) MMP3MMP13RAB9ANPC1MYC
SCHEMBL3763217 0.92 PIM1 (0.52) RAB9ANPC1POLB
SCHEMBL3763213 0.92 PIM1 (0.52) RAB9ANPC1POLB
SCHEMBL12997337 0.89 CISD1 (0.50) RAB9ANPC1MYCMAXDYRK1A
SCHEMBL3761342 0.89 CISD1 (0.50) RAB9ANPC1MYCMAXDYRK1A
SCHEMBL12997331 0.89 PDE4B (0.57) DYRK1AMEN1KMT2APIK3CGADAMTS5
SCHEMBL12997326 0.89 PDE4B (0.48) MMP3MMP13RAB9ANPC1MYC
SCHEMBL3761343 0.89 CISD1 (0.50) RAB9ANPC1MYCMAXDYRK1A
SCHEMBL3765526 0.89 MMP3 (0.55) MMP3MMP13RAB9ANPC1MYC

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-20100305174-A1 Novel Heterocyclic Derivatives ORCHID RESEARCH LABORATORIES LIMITED (IN) 2010-12-02 US claimed
EP-1868990-A2 NOVEL HETEROCYCLIC DERIVATIVES Orchid Research Laboratories Limited (IN) 2007-12-26 EP claimed
WO-2006109146-A2 NOVEL HETEROCYCLIC DERIVATIVES ORCHID RESEARCH LABORATORIES LIMITED (IN) 2006-10-19 WO claimed
US-20100305174-A1 Novel Heterocyclic Derivatives ORCHID RESEARCH LABORATORIES LIMITED (IN) 2010-12-02 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 (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-20100305174-A1 Novel Heterocyclic Derivatives UGT1A1, CYP3A4, CYP3A43 MMP3 3218/4885MMP13 3666/4885RAB9A 1155/4885

“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.