SCHEMBL8750202

SCHEMBL8750202

CCCCOC(=O)NN1C(=O)Cc2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.43
BCHE P06276 1/20 0.42
ALDH1A1 P00352 3/20 0.42
SMN1; SMN2 Q16637 9/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C19 P33261 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
RAB9A P51151 9/20 0.39
NPC1 O15118 8/20 0.39
MAPT P10636 3/20 0.39
NFKB1 P19838 2/20 0.39
NFKB2 Q00653 2/20 0.39
RELA Q04206 2/20 0.39
TP53 P04637 1/20 0.39
HPGD P15428 3/20 0.39
LMNA P02545 2/20 0.39

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
SCHEMBL8633273 0.85 L3MBTL1 (0.40) NOTUMBCHEALDH1A1SMN1; SMN2CYP1A2
SCHEMBL27569955 0.78 BCHE (0.58) NOTUMBCHEALDH1A1SMN1; SMN2TDP1
SCHEMBL4413239 0.76 NOTUM (0.47) NOTUMBCHEL3MBTL1KMT2AMEN1
SCHEMBL4632276 0.76 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2CYP1A2CYP2C19TDP1
SCHEMBL27801593 0.76 NOTUM (0.41) NOTUMBCHEALDH1A1SMN1; SMN2TDP1
SCHEMBL7476038 0.75 NOTUM (0.58) NOTUMALDH1A1SMN1; SMN2TDP1L3MBTL1
SCHEMBL8520283 0.74 SMN1; SMN2 (0.39) BCHEALDH1A1SMN1; SMN2CYP1A2CYP2C19
SCHEMBL8860170 0.71 NOTUM (0.45) NOTUMTDP1L3MBTL1KMT2AMEN1
SCHEMBL7717408 0.70 MEN1 (0.51) NOTUMALDH1A1SMN1; SMN2CYP2C19L3MBTL1
SCHEMBL16586606 0.69 BCHE (0.56) BCHEALDH1A1TDP1L3MBTL1TSHR

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
EP-0764152-A1 SUBSTITUTED INDOLYLMETHYLENE-OXINDOLE ANALOGUES AS TYROSINE KINASE INHIBITORS PHARMACIA & UPJOHN S.p.A. (IT) 1997-03-26 EP disclosed
WO-1996032380-A1 SUBSTITUTED INDOLYLMETHYLENE-OXINDOLE ANALOGUES AS TYROSINE KINASE INHIBITORS PHARMACIA & UPJOHN S.P.A. (IT) 1996-10-17 WO disclosed