SCHEMBL8633273

SCHEMBL8633273

CCCCOC(=O)NC(C)C(=O)NC(C)C(=O)NN1C(=O)Cc2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.40
TAOK3 Q9H2K8 3/20 0.38
TAOK1 Q7L7X3 2/20 0.38
ELANE P08246 1/20 0.37
SMN1; SMN2 Q16637 4/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
HPGD P15428 1/20 0.36
ACE P12821 2/20 0.36
ACE2 Q9BYF1 2/20 0.36
CTSK P43235 2/20 0.36
ALDH1A1 P00352 1/20 0.36
BCHE P06276 1/20 0.35
NOTUM Q6P988 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
LMNA P02545 1/20 0.34
PLD1 Q13393 1/20 0.34
TSHR P16473 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL8750202 0.85 NOTUM (0.43) L3MBTL1SMN1; SMN2NPC1RAB9AHPGD
SCHEMBL6306458 0.71 SCN9A (0.40) L3MBTL1
SCHEMBL7849872 0.71 PSEN1 (0.48) SMN1; SMN2NPC1RAB9ACTSKALDH1A1
SCHEMBL27569955 0.70 BCHE (0.58) L3MBTL1SMN1; SMN2ALDH1A1BCHENOTUM
SCHEMBL7598202 0.69 CCKBR (0.53)
SCHEMBL7616231 0.69 MME (0.42) L3MBTL1SMN1; SMN2NPC1RAB9AHPGD
SCHEMBL6920745 0.67 CCKBR (0.41) TAOK3TAOK1SMN1; SMN2NPC1RAB9A
SCHEMBL17164501 0.67 CTSK (0.49) L3MBTL1SMN1; SMN2NPC1RAB9AHPGD
SCHEMBL8520283 0.67 SMN1; SMN2 (0.39) L3MBTL1SMN1; SMN2NPC1RAB9AHPGD
SCHEMBL17603549 0.66 NOTUM (0.49) L3MBTL1HPGDNOTUMLMNAPLD1

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-0853614-A1 SUBSTITUTED TETRALYLMETHYLEN-OXINDOLE ANALOGUES AS TYROSINE KINASE INHIBITORS PHARMACIA & UPJOHN S.p.A. (IT) 1998-07-22 EP disclosed
WO-1997045409-A1 SUBSTITUTED TETRALYLMETHYLEN-OXINDOLE ANALOGUES AS TYROSINE KINASE INHIBITORS PHARMACIA & UPJOHN, S.P.A. (IT) 1997-12-04 WO disclosed