SCHEMBL3763217

SCHEMBL3763217

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

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 4/20 0.52
PIM2 Q9P1W9 4/20 0.52
HPGD P15428 10/20 0.50
AKR1B1 P15121 3/20 0.50
CISD1 Q9NZ45 1/20 0.49
IGF1R P08069 1/20 0.49
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
PTPN1 P18031 2/20 0.44
PYGL P06737 1/20 0.43
POLB P06746 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43

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
SCHEMBL3763213 1.00 PIM1 (0.52) PIM1PIM2HPGDAKR1B1CISD1
SCHEMBL12997315 0.92 MMP3 (0.53) NPC1RAB9APOLB
SCHEMBL3761292 0.92 MMP3 (0.53) NPC1RAB9APOLB
SCHEMBL3761296 0.92 MMP3 (0.53) NPC1RAB9APOLB
SCHEMBL3763212 0.90 ESRRA (0.58) PIM1PIM2HPGDIGF1RPYGL
SCHEMBL3761632 0.90 HPGD (0.51) HPGD
SCHEMBL3763210 0.90 ESRRA (0.58) PIM1PIM2HPGDIGF1RPYGL
SCHEMBL3762303 0.90 ESRRA (0.45) PIM1PIM2HPGDCISD1IGF1R
SCHEMBL3761628 0.90 HPGD (0.51) HPGD
SCHEMBL3762308 0.90 ESRRA (0.45) PIM1PIM2HPGDCISD1IGF1R

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-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
EP-1868990-A2 NOVEL HETEROCYCLIC DERIVATIVES Orchid Research Laboratories Limited (IN) 2007-12-26 EP disclosed
WO-2006109146-A2 NOVEL HETEROCYCLIC DERIVATIVES ORCHID RESEARCH LABORATORIES LIMITED (IN) 2006-10-19 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-20100305174-A1 Novel Heterocyclic Derivatives UGT1A1, CYP3A4, CYP3A43 PIM1 1211/4885PIM2 2123/4885HPGD 228/4885

“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.