SCHEMBL7422702

SCHEMBL7422702

O=C1Nc2ccccc2C1=CCc1ncco1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 1/20 0.49
▸ RPS6KA3 P51812 1/20 0.49
▸ TLK2 Q86UE8 2/20 0.47
▸ MAPT P10636 7/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ NPSR1 Q6W5P4 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ EGFR P00533 1/20 0.44
▸ HTT P42858 2/20 0.44
▸ NPC1 O15118 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ POLB P06746 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ TGM2 P21980 1/20 0.43
▸ IDO1 P14902 1/20 0.43
▸ GAA P10253 1/20 0.42

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
SCHEMBL6001282 0.81 RPS6KA3 (0.61) GSK3BRPS6KA3TLK2MAPTSMN1; SMN2
SCHEMBL6001279 0.81 RPS6KA3 (0.61) GSK3BRPS6KA3TLK2MAPTSMN1; SMN2
SCHEMBL7534633 0.75 GSK3B (0.47) GSK3BRPS6KA3TLK2MAPTALDH1A1
SCHEMBL1444503 0.74 MAPT (0.54) RPS6KA3MAPTALDH1A1SMN1; SMN2MAPK1
SCHEMBL1444136 0.74 MAPT (0.54) RPS6KA3MAPTALDH1A1SMN1; SMN2MAPK1
SCHEMBL7421021 0.71 GSK3B (0.46) GSK3BRPS6KA3TLK2MAPTALDH1A1
SCHEMBL7418882 0.70 PDGFRB (0.58) RPS6KA3TLK2MAPTALDH1A1SMN1; SMN2
SCHEMBL28213543 0.70 CCNB2 (0.57) MAPTALDH1A1SMN1; SMN2MAPK1NPSR1
SCHEMBL7420796 0.69 SMN1; SMN2 (0.49) RPS6KA3MAPTALDH1A1SMN1; SMN2MAPK1
SCHEMBL7416167 0.69 ALDH1A1 (0.61) GSK3BRPS6KA3MAPTALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0769947-A4 INDOLINONE COMPOUNDS FOR THE TREATMENT OF DISEASE SUGEN INC (US) 1998-09-30 — — EP disclosed
EP-0769947-A1 INDOLINONE COMPOUNDS FOR THE TREATMENT OF DISEASE Sugen, Inc. (US) 1997-05-02 — — EP disclosed
WO-1996040116-A1 INDOLINONE COMPOUNDS FOR THE TREATMENT OF DISEASE SUGEN, INC. (US) 1996-12-19 — — WO disclosed
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