Oxindole

Oxindole

SCHEMBL28780321

C1CNCCN1.O=C1Cc2ccccc2N1.c1ccncc1

nearest known ligand 0.66

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ESR1

The experimentally established mechanism targets of Oxindole. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 4/20 0.66
▸ PDK2 Q15119 1/20 0.66
▸ PDE3B Q13370 1/20 0.49
▸ PDE3A Q14432 1/20 0.49
▸ CYP1A2 P05177 1/20 0.47
▸ CYP11B1 P15538 1/20 0.47
▸ CYP11B2 P19099 1/20 0.47
▸ NPC1 O15118 2/20 0.46
▸ MAPK13 O15264 1/20 0.46
▸ MAPK12 P53778 1/20 0.46
▸ MAPK11 Q15759 1/20 0.46
▸ MAPK14 Q16539 1/20 0.46
▸ MAPT P10636 4/20 0.44
▸ SRC P12931 1/20 0.42
▸ TDP2 O95551 1/20 0.41
▸ CASP3 P42574 1/20 0.41
▸ CASP7 P55210 1/20 0.41
▸ CASP9 P55211 1/20 0.41
▸ CASP6 P55212 1/20 0.41
▸ CASP8 Q14790 1/20 0.41

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
Oxindole SCHEMBL3866757 0.94 AHR (0.75) AHRPDK2PDE3BPDE3ACYP1A2
Oxindole SCHEMBL28298966 0.88 AHR (0.84) AHRPDK2NPC1MAPK13MAPK12
Oxindole SCHEMBL3802438 0.87 AHR (0.81) AHRPDK2PDE3BPDE3ACYP1A2
Oxindole SCHEMBL14324689 0.83 AHR (0.75) AHRPDK2PDE3BPDE3ACYP1A2
Oxindole SCHEMBL29260649 0.83 AHR (0.95) AHRPDK2NPC1MAPK13MAPK12
Oxindole SCHEMBL28796829 0.82 AHR (0.78) AHRPDK2NPC1MAPK13MAPK12
Oxindole SCHEMBL29358826 0.81 AHR (1.00) AHRPDK2PDE3BPDE3ANPC1
Oxindole SCHEMBL19504 0.81 AHR (1.00) AHRPDK2PDE3BPDE3ANPC1
Oxindole SCHEMBL1144643 0.81 AHR (1.00) AHRPDK2PDE3BPDE3ANPC1
Biphenyl SCHEMBL29191442 0.79 AHR (0.88) AHRPDK2PDE3BPDE3ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101437692-B Printing spacer material ASAHI CHEMICAL CORP (JP) 2011-02-02 — — CN disclosed
CN-101437692-A Printing spacer material ASAHI CHEMICAL CORP (JP) 2009-05-20 — — CN disclosed
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