SCHEMBL10399644

SCHEMBL10399644

COc1cccc(N2C(=O)/C(=C\N(C)C)c3ccccc32)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
KMT2A Q03164 5/20 0.50
MEN1 O00255 4/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
HPGD P15428 2/20 0.50
HSD17B10 Q99714 1/20 0.50
MAPT P10636 9/20 0.47
APP P05067 3/20 0.47
SNCA P37840 3/20 0.47
MGLL Q99685 1/20 0.47
NR1H3 Q13133 2/20 0.46
KDM4E B2RXH2 1/20 0.44
NR1H2 P55055 1/20 0.43
HTT P42858 2/20 0.42
USP2 O75604 1/20 0.42
POLB P06746 1/20 0.42
RECQL P46063 1/20 0.42
GAA P10253 1/20 0.42
GFER P55789 1/20 0.42
SCN2A Q99250 1/20 0.41

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
SCHEMBL10399645 1.00 ALDH1A1 (0.50) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
SCHEMBL10399797 0.87 ALDH1A1 (0.52) ALDH1A1KMT2AMEN1SMN1; SMN2HSD17B10
SCHEMBL10399799 0.87 ALDH1A1 (0.52) ALDH1A1KMT2AMEN1SMN1; SMN2HSD17B10
SCHEMBL10555231 0.87 ALDH1A1 (0.53) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
SCHEMBL10555230 0.87 ALDH1A1 (0.53) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
SCHEMBL10398754 0.85 ALDH1A1 (0.52) ALDH1A1KMT2AMEN1SMN1; SMN2HSD17B10
SCHEMBL10398635 0.85 ALDH1A1 (0.52) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
SCHEMBL10398636 0.85 ALDH1A1 (0.52) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
SCHEMBL10398755 0.85 ALDH1A1 (0.52) ALDH1A1KMT2AMEN1SMN1; SMN2HSD17B10
SCHEMBL10399669 0.84 ALDH1A1 (0.49) ALDH1A1KMT2AMEN1HSD17B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4977178-A Method of treating anxiety and depression with 1-phenyl-2(1H,3H)-indolone psycho-therapeutic agents PFIZER INC. (US) 1990-12-11 US disclosed
US-4879391-A 1-Phenyl-2(1H,3H)-indolone psychotherapeutic agents PFIZER INC. (US) 1989-11-07 US disclosed
US-4861880-A 1-phenyl-2(1H,3H)-indolone psycho-therapeutic agents PFIZER INC. (US) 1989-08-29 US disclosed
US-4476307-A Heteroylidene indolone compounds PFIZER INC. (US) 1984-10-09 US disclosed
EP-0104860-A1 1-Phenyl-2(1H,3H)-indolone psycho-therapeutic agents PFIZER INC. (US) 1984-04-04 EP disclosed