SCHEMBL529968

SCHEMBL529968

Nc1cc2cc(O)ccc2[nH]1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 8/20 0.55
PDGFRB P09619 3/20 0.55
KIT P10721 2/20 0.55
ABL1 P00519 1/20 0.55
BCR P11274 1/20 0.55
CA2 P00918 1/20 0.55
AOC3 Q16853 2/20 0.54
SMAD3 P84022 1/20 0.53
PDGFRA P16234 1/20 0.47
USP2 O75604 1/20 0.47
GAA P10253 1/20 0.47
ALOX15 P16050 1/20 0.47
RAD51 Q06609 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
PLAU P00749 1/20 0.46
CLK1 P49759 1/20 0.45
DYRK1A Q13627 1/20 0.45
CDK5 Q00535 3/20 0.44
CDK5R1 Q15078 3/20 0.44
EHMT2 Q96KQ7 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
SCHEMBL27512966 0.83 CA2 (0.55) FLT3PDGFRBKITABL1BCR
SCHEMBL32666155 0.77 FLT3 (0.59) FLT3PDGFRBKITABL1BCR
SCHEMBL6019304 0.77 CYP2A6 (0.63) AOC3GAAALOX15PLAUEHMT2
SCHEMBL2454392 0.77 FLT3 (0.59) FLT3PDGFRBKITABL1BCR
SCHEMBL12348 0.74 CYP2A6 (0.59) FLT3PDGFRBKITABL1BCR
SCHEMBL12778106 0.74 FLT3 (0.55) FLT3PDGFRBKITABL1BCR
SCHEMBL28745423 0.74 FLT3 (0.55) FLT3PDGFRBKITABL1BCR
SCHEMBL5706427 0.74 AOC3 (0.54) FLT3AOC3EHMT2HRH4
SCHEMBL1465978 0.74 LOXL2 (0.58) FLT3AOC3ALOX15EHMT2HRH4
SCHEMBL29042581 0.74 AOC3 (0.54) CA2AOC3EHMT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10222390-B2 Near-infrared fluorescent sensors for biological amines THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2019-03-05 US disclosed
US-20170082645-A1 NEAR-INFRARED FLUORESCENT SENSORS FOR BIOLOGICAL AMINES THE CURATORS OF THE UNIVERSITY OF MISSOURI 2017-03-23 US disclosed
WO-2012014127-A1 5-LIPOXYGENASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2012-02-02 WO disclosed
WO-2011161615-A1 5-LIPOXYGENASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2011-12-29 WO disclosed
CN-102127058-A Pyrimidine derivatives for the treatment of abnormal cell growth PFIZER PROD INC 2011-07-20 CN disclosed
CN-1953974-A Pyrimidine derivatives for the treatment of abnormal cell growth PFIZER (US) 2007-04-25 CN disclosed
CN-1250526-C Pyrrole substituted 2-indolinone protein kinase inhibitors SUGEN INC (US) 2006-04-12 CN disclosed
CN-1311775-A Pyrrole substituted 2-indolinone protein kinase inhibitors SUGEN INC (US) 2001-09-05 CN disclosed