SCHEMBL8769620

SCHEMBL8769620

CN(C)c1ccc(C(=O)N/N=C/c2cc(/C=N/NC(=O)c3ccc(N(C)C)cc3)cc(NCc3ccccc3)c2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.63
ALDH1A1 P00352 6/20 0.63
KMT2A Q03164 6/20 0.63
RAB9A P51151 6/20 0.63
NPC1 O15118 5/20 0.63
PKM P14618 2/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
KDM4E B2RXH2 6/20 0.61
HDAC8 Q9BY41 2/20 0.56
HDAC6 Q9UBN7 2/20 0.56
ESRRG P62508 2/20 0.56
HPGD P15428 2/20 0.54
GAA P10253 1/20 0.54
MPO P05164 1/20 0.52
MEN1 O00255 3/20 0.52
CYP1A2 P05177 2/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
TDP1 Q9NUW8 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
SCHEMBL12789179 0.86 MAPT (0.65) MAPTALDH1A1KMT2ARAB9ANPC1
SCHEMBL6120018 0.84 MAPT (0.80) MAPTALDH1A1KMT2ARAB9ANPC1
SCHEMBL8771645 0.84 MAPT (0.80) MAPTALDH1A1KMT2ARAB9ANPC1
SCHEMBL8770578 0.83 HDAC6 (0.59) MAPTALDH1A1KMT2ARAB9ANPC1
SCHEMBL8769226 0.82 KMT2A (0.67) MAPTALDH1A1KMT2ARAB9ANPC1
SCHEMBL8768047 0.82 MAPT (0.72) MAPTALDH1A1KMT2ARAB9ANPC1
SCHEMBL8768051 0.81 HDAC8 (0.66) MAPTALDH1A1KMT2ARAB9ANPC1
SCHEMBL8769123 0.81 MAPT (0.58) MAPTALDH1A1KMT2ARAB9ANPC1
SCHEMBL20328281 0.81 MAPT (0.89) MAPTALDH1A1KMT2ARAB9ANPC1
SCHEMBL21531471 0.81 MAPT (0.89) MAPTALDH1A1KMT2ARAB9ANPC1

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 7 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-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-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
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 4622/4885ALDH1A1 3228/4885KMT2A 2225/4885
US-20150252043-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF MAPT 4411/4885ALDH1A1 2736/4885KMT2A 806/4885
US-20120295904-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF MAPT 4411/4885ALDH1A1 2736/4885KMT2A 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.