SCHEMBL7780550

SCHEMBL7780550

O=C1Nc2ccc(O)cc2C1=Cc1c[nH]c2ccc(C(=O)O)cc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 7/20 0.65
PDPK1 O15530 5/20 0.52
TLK2 Q86UE8 3/20 0.52
JAK3 P52333 1/20 0.52
KDR P35968 5/20 0.50
PDGFRB P09619 4/20 0.50
RET P07949 3/20 0.50
NTRK3 Q16288 3/20 0.50
NTRK2 Q16620 3/20 0.50
PRKD3 O94806 2/20 0.50
ABL1 P00519 2/20 0.50
LTK P29376 2/20 0.50
FLT3 P36888 2/20 0.50
CSNK1A1 P48729 2/20 0.50
CDK7 P50613 2/20 0.50
MAP2K1 Q02750 2/20 0.50
MST1R Q04912 2/20 0.50
AURKB Q96GD4 2/20 0.50
CLK4 Q9HAZ1 2/20 0.50
ALK Q9UM73 2/20 0.50

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
SCHEMBL7875958 0.96 NTRK1 (0.68) NTRK1PDPK1TLK2JAK3KDR
SCHEMBL7780557 0.90 NTRK1 (0.78) NTRK1PDPK1KDRPDGFRBRET
SCHEMBL7874199 0.87 NTRK1 (0.68) NTRK1PDPK1TLK2JAK3KDR
SCHEMBL6406647 0.84 NTRK1 (0.68) NTRK1PDPK1TLK2JAK3KDR
SCHEMBL16568134 0.84 NTRK1 (0.68) NTRK1PDPK1TLK2JAK3KDR
SCHEMBL6406651 0.84 NTRK1 (0.68) NTRK1PDPK1TLK2JAK3KDR
SCHEMBL7775172 0.84 NTRK1 (0.70) NTRK1PDPK1KDRPDGFRBRET
SCHEMBL5472578 0.83 NTRK1 (0.73) NTRK1PDPK1KDRPDGFRBRET
SCHEMBL14448928 0.83 NTRK1 (0.73) NTRK1PDPK1KDRPDGFRBRET
SCHEMBL5472580 0.83 NTRK1 (0.73) NTRK1PDPK1KDRPDGFRBRET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0552329-B1 METHYLEN-OXINDOLE DERIVATIVES AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN SPA (IT) 2001-10-04 EP claimed
EP-0684820-B1 BIOLOGICALLY ACTIVE 3-SUBSTITUTED OXINDOLE DERIVATIVES USEFUL AS ANTI-ANGIOGENIC AGENTS PHARMACIA & UPJOHN SPA (IT) 2001-08-16 EP claimed
US-5409949-A Methylen-oxindole derivatives compositions and tyrosine kinase inhibition therewith FARMITALIA CARLO ERBA S.R.L. (IT) 1995-04-25 US claimed
EP-0552329-A1 METHYLEN-OXINDOLE DERIVATIVES AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN S.p.A. (IT) 1993-07-28 EP claimed
EP-0525472-A2 Methylen-oxindole derivatives and process for their preparation PHARMACIA S.p.A. (IT) 1993-02-03 EP claimed
WO-1993001182-A1 METHYLEN-OXINDOLE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA SRL (IT) 1993-01-21 WO claimed
EP-0552329-B1 METHYLEN-OXINDOLE DERIVATIVES AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN SPA (IT) 2001-10-04 EP disclosed
US-5409949-A Methylen-oxindole derivatives compositions and tyrosine kinase inhibition therewith FARMITALIA CARLO ERBA S.R.L. (IT) 1995-04-25 US disclosed
EP-0552329-A1 METHYLEN-OXINDOLE DERIVATIVES AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN S.p.A. (IT) 1993-07-28 EP disclosed
EP-0525472-A2 Methylen-oxindole derivatives and process for their preparation PHARMACIA S.p.A. (IT) 1993-02-03 EP disclosed
WO-1993001182-A1 METHYLEN-OXINDOLE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA SRL (IT) 1993-01-21 WO disclosed