SCHEMBL8771506

SCHEMBL8771506

C=CCOc1cc(/C=N/NC(=O)c2ccc(N(C)C)cc2)cc(/C=N/NC(=O)c2ccc(N(C)C)cc2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 3/20 0.57
HDAC8 Q9BY41 2/20 0.57
ESRRG P62508 2/20 0.57
MAPT P10636 10/20 0.56
ALDH1A1 P00352 7/20 0.56
KDM4E B2RXH2 7/20 0.56
KMT2A Q03164 6/20 0.56
NPC1 O15118 4/20 0.55
RAB9A P51151 4/20 0.55
PKM P14618 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
MPO P05164 1/20 0.53
POLB P06746 1/20 0.49
GFER P55789 1/20 0.49
MEN1 O00255 3/20 0.48
CYP3A4 P08684 2/20 0.48
CYP1A2 P05177 1/20 0.48
MAPK1 P28482 1/20 0.47
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.46

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
SCHEMBL8769635 0.84 HDAC8 (0.72) HDAC6HDAC8ESRRGMAPTALDH1A1
SCHEMBL8768655 0.83 HDAC8 (0.64) HDAC6HDAC8ESRRGMAPTALDH1A1
SCHEMBL8769226 0.83 KMT2A (0.67) HDAC6HDAC8ESRRGMAPTALDH1A1
SCHEMBL12937910 0.82 HDAC8 (0.62) HDAC6HDAC8ESRRGMAPTALDH1A1
SCHEMBL12791111 0.78 HDAC8 (0.81) HDAC6HDAC8ESRRGMAPTALDH1A1
SCHEMBL12937884 0.78 HDAC8 (0.72) HDAC6HDAC8ESRRGMAPTALDH1A1
SCHEMBL8768051 0.77 HDAC8 (0.66) HDAC6HDAC8ESRRGMAPTALDH1A1
SCHEMBL13568949 0.77 MEN1 (0.59) ALDH1A1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL13568927 0.76 MEN1 (0.65) MAPTALDH1A1KDM4EKMT2ANPC1
SCHEMBL12937916 0.76 HDAC8 (0.63) HDAC6HDAC8ESRRGMAPTALDH1A1

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 HDAC6 3930/4885HDAC8 3359/4885ESRRG 162/4885
US-20150252043-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF HDAC6 3025/4885HDAC8 1812/4885ESRRG 228/4885
US-20120295904-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF HDAC6 3025/4885HDAC8 1812/4885ESRRG 228/4885

“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.