SCHEMBL3763210

SCHEMBL3763210

CCN1C(=O)OCC1Cc1ccc(Oc2ccc(/C=C3/SC(=O)NC3=O)cc2OC)cc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ESRRA P11474 10/20 0.58
IGF1R P08069 1/20 0.55
PIM1 P11309 1/20 0.53
PDE4B Q07343 1/20 0.53
PIM3 Q86V86 1/20 0.53
PIM2 Q9P1W9 1/20 0.53
PYGL P06737 1/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
MAPT P10636 2/20 0.47
MCL1 Q07820 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
GFER P55789 1/20 0.47
CYP3A4 P08684 1/20 0.47
HPGD P15428 1/20 0.47

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
SCHEMBL3763212 1.00 ESRRA (0.58) ESRRAIGF1RPIM1PDE4BPIM3
SCHEMBL12997331 0.93 PDE4B (0.57) ESRRAPIM1PDE4BPIM3PIM2
SCHEMBL3762308 0.90 ESRRA (0.45) ESRRAIGF1RPIM1PDE4BPIM3
SCHEMBL3761632 0.90 HPGD (0.51) ESRRAHPGD
SCHEMBL3761628 0.90 HPGD (0.51) ESRRAHPGD
SCHEMBL3762303 0.90 ESRRA (0.45) ESRRAIGF1RPIM1PDE4BPIM3
SCHEMBL3758497 0.90 ESRRA (0.58) ESRRAIGF1RPIM1PDE4BPIM3
SCHEMBL3758500 0.90 ESRRA (0.58) ESRRAIGF1RPIM1PDE4BPIM3
SCHEMBL3763213 0.90 PIM1 (0.52) IGF1RPIM1PIM2PYGLPOLB
SCHEMBL3763217 0.90 PIM1 (0.52) IGF1RPIM1PIM2PYGLPOLB

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
US-20100305174-A1 Novel Heterocyclic Derivatives ORCHID RESEARCH LABORATORIES LIMITED (IN) 2010-12-02 US claimed
US-20100305174-A1 Novel Heterocyclic Derivatives ORCHID RESEARCH LABORATORIES LIMITED (IN) 2010-12-02 US disclosed
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 ESRRA 3987/4885IGF1R 4301/4885PIM1 1211/4885

“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.