SCHEMBL8770655

SCHEMBL8770655

O=C(Nc1ccc(Nc2ccc(NC(=O)c3ccc(-n4cccc4)cc3)cc2)cc1)c1ccc(-n2cccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AOC2 O75106 1/20 0.60
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
POLB P06746 3/20 0.55
RAB9A P51151 6/20 0.55
LMNA P02545 3/20 0.55
MAPT P10636 4/20 0.54
RXFP1 Q9HBX9 1/20 0.54
SERPINE1 P05121 2/20 0.50
NPC1 O15118 2/20 0.50
KDM4E B2RXH2 1/20 0.50
HTT P42858 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
ALDH1A1 P00352 1/20 0.49
HPGD P15428 1/20 0.49
PTPN1 P18031 1/20 0.49

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
SCHEMBL21254600 0.90 RAB9A (0.50) AOC2MEN1KMT2APOLBRAB9A
SCHEMBL1666858 0.90 RAB9A (0.64) AOC2MEN1KMT2APOLBRAB9A
SCHEMBL1664421 0.82 RXFP1 (0.78) MEN1KMT2APOLBRAB9ALMNA
SCHEMBL8770808 0.81 ROCK1 (0.60) KMT2APOLBLMNAMAPTRXFP1
SCHEMBL11124245 0.78 MEN1 (0.83) MEN1KMT2APOLBRAB9ANPC1
SCHEMBL27868382 0.78 RAB9A (0.47) MEN1KMT2APOLBRAB9ALMNA
SCHEMBL8769758 0.77 ALDH1A1 (0.55) MEN1KMT2APOLBRAB9ALMNA
SCHEMBL27874681 0.77 MEN1 (0.58) AOC2MEN1KMT2APOLBRAB9A
SCHEMBL18330583 0.76 PTPN1 (0.77) MEN1KMT2APOLBRAB9AMAPT
SCHEMBL21254474 0.76 KMT2A (0.57) KMT2APOLBLMNAMAPTRXFP1

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
EP-2488486-B1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARM INC (US) 2019-08-14 EP 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-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 AOC2 4703/4885MEN1 1370/4885KMT2A 2225/4885
US-20150252043-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF AOC2 4836/4885MEN1 1395/4885KMT2A 806/4885
US-20120295904-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF AOC2 4836/4885MEN1 1395/4885KMT2A 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.