SCHEMBL8771645

SCHEMBL8771645

CN(C)c1ccc(C(=O)N/N=C/c2cc(/C=N/NC(=O)c3ccc(N(C)C)cc3)cc(NC(=O)c3ccccc3)c2)cc1

nearest known ligand 0.80

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.80
KDM4E B2RXH2 2/20 0.80
KMT2A Q03164 5/20 0.73
RAB9A P51151 4/20 0.73
ALDH1A1 P00352 2/20 0.73
NPC1 O15118 2/20 0.73
PKM P14618 1/20 0.73
SMN1; SMN2 Q16637 1/20 0.73
HDAC8 Q9BY41 2/20 0.63
HDAC6 Q9UBN7 2/20 0.63
KCNK3 O14649 1/20 0.61
ESRRG P62508 2/20 0.60
ASF1A Q9Y294 4/20 0.59
MPO P05164 1/20 0.56
MEN1 O00255 3/20 0.54
POLB P06746 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
IDO1 P14902 1/20 0.52

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
SCHEMBL6120018 1.00 MAPT (0.80) MAPTKDM4EKMT2ARAB9AALDH1A1
SCHEMBL8768047 0.85 MAPT (0.72) MAPTKDM4EKMT2ARAB9AALDH1A1
SCHEMBL8768051 0.85 HDAC8 (0.66) MAPTKDM4EKMT2ARAB9AALDH1A1
SCHEMBL8769635 0.85 HDAC8 (0.72) MAPTKDM4EKMT2ARAB9AALDH1A1
SCHEMBL1563651 0.85 MAPT (1.00) MAPTKDM4EKMT2ARAB9AALDH1A1
SCHEMBL1563653 0.85 MAPT (1.00) MAPTKDM4EKMT2ARAB9AALDH1A1
SCHEMBL20328281 0.85 MAPT (0.89) MAPTKDM4EKMT2ARAB9AALDH1A1
SCHEMBL6634490 0.85 MAPT (1.00) MAPTKDM4EKMT2ARAB9AALDH1A1
SCHEMBL21531471 0.85 MAPT (0.89) MAPTKDM4EKMT2ARAB9AALDH1A1
SCHEMBL8769620 0.84 MAPT (0.63) MAPTKDM4EKMT2ARAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9622991-B2 Hematopoietic growth factor mimetic small molecule compounds and their uses LIGAND PHARMACEUTICALS INC. (US) 2017-04-18 US disclosed
US-9622991-B2 Hematopoietic growth factor mimetic small molecule compounds and their uses LIGAND PHARMACEUTICALS INC. (US) 2017-04-18 US disclosed
US-9144557-B2 Hematopoietic growth factor mimetic small molecule compounds and their uses LIGAND PHARMACEUTICALS INC. (US) 2015-09-29 US disclosed
US-9144557-B2 Hematopoietic growth factor mimetic small molecule compounds and their uses LIGAND PHARMACEUTICALS INC. (US) 2015-09-29 US disclosed
US-20150252043-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES CITIBANK, N.A., AS ADMINISTRATIVE AGENT 2015-09-10 US disclosed
US-20150252043-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES CITIBANK, N.A., AS ADMINISTRATIVE AGENT 2015-09-10 US disclosed
US-20140243324-A1 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS LIGAND PHARMACEUTICALS INCORPORATED (US) 2014-08-28 US disclosed
US-20140243324-A1 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS LIGAND PHARMACEUTICALS INCORPORATED (US) 2014-08-28 US disclosed
US-20120295904-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2012-11-22 US disclosed
US-20120295904-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2012-11-22 US disclosed
WO-2012068406-A2 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS LIGAND PHARMACEUTICALS INCORPORATED (US) 2012-05-24 WO disclosed
WO-2011046954-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2011-04-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140243324-A1 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS HGF, EPOR, MPL MAPT 4622/4885KDM4E 3484/4885KMT2A 2225/4885
US-20150252043-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF MAPT 4411/4885KDM4E 1944/4885KMT2A 806/4885
US-20120295904-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF MAPT 4411/4885KDM4E 1944/4885KMT2A 806/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.