SCHEMBL7720615

SCHEMBL7720615

Cc1cc(N/C=C2\C(=O)Nc3ccc4ncccc4c32)ccc1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IL1B P01584 1/20 0.43
MAPT P10636 5/20 0.38
RAB9A P51151 4/20 0.38
NPC1 O15118 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
LMNA P02545 2/20 0.38
MYC P01106 1/20 0.37
ACLY P53396 1/20 0.36
AKT2 P31751 1/20 0.34
TLK2 Q86UE8 3/20 0.33
CYP19A1 P11511 1/20 0.33
TGM2 P21980 1/20 0.33
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
MAPK1 P28482 1/20 0.33
CHEK1 O14757 1/20 0.33
POLB P06746 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL7720618 1.00 IL1B (0.43) IL1BMAPTRAB9ANPC1MEN1
SCHEMBL7732180 0.90 IL1B (0.39) IL1BMAPTRAB9ANPC1MEN1
SCHEMBL7732189 0.90 IL1B (0.39) IL1BMAPTRAB9ANPC1MEN1
SCHEMBL5873772 0.86 RAB9A (0.43) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL5873767 0.86 RAB9A (0.43) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL5432754 0.83 ALDH1A1 (0.42) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL5432755 0.83 ALDH1A1 (0.42) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL5427502 0.82 DHODH (0.38) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL5427494 0.82 DHODH (0.38) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL5873967 0.82 DHODH (0.38) MAPTRAB9ANPC1MEN1KMT2A

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-1165514-A1 3-(ANILINOMETHYLENE) OXINDOLES AS PROTEIN TYROSINE KINASE AND PROTEIN SERINE/THREONINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2002-01-02 EP claimed
WO-2000056710-A1 3-(ANILINOMETHYLENE) OXINDOLES AS PROTEIN TYROSINE KINASE AND PROTEIN SERINE/THREONINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2000-09-28 WO claimed