SCHEMBL1663170

SCHEMBL1663170

CN(C)c1ccc(C(=O)Nc2ccc3c(cnn3-c3ccc([N+](=O)[O-])cc3)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.53
MAPK1 P28482 3/20 0.53
ALDH1A1 P00352 3/20 0.53
MAOB P27338 1/20 0.49
RAB9A P51151 6/20 0.47
KMT2A Q03164 7/20 0.47
MEN1 O00255 6/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
GFER P55789 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
NPC1 O15118 3/20 0.46
MCL1 Q07820 1/20 0.46
ATM Q13315 1/20 0.46
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
TP53 P04637 1/20 0.44
BAZ1A Q9NRL2 1/20 0.43

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
SCHEMBL1663507 0.90 MAOB (0.56) MAPTMAPK1ALDH1A1MAOBRAB9A
SCHEMBL1663505 0.88 MAOB (0.54) MAPTMAPK1ALDH1A1MAOBRAB9A
SCHEMBL1666595 0.86 MAOB (0.52) MAPTMAPK1ALDH1A1MAOBRAB9A
SCHEMBL13836343 0.86 MAOB (0.55) MAPTMAPK1ALDH1A1MAOBRAB9A
SCHEMBL1666113 0.86 MAOB (0.52) MAPTMAPK1ALDH1A1MAOBRAB9A
SCHEMBL1664500 0.86 MAOB (0.63) MAPTMAPK1ALDH1A1MAOBRAB9A
SCHEMBL1664498 0.84 MAOB (0.58) MAPTMAPK1ALDH1A1MAOBRAB9A
SCHEMBL1666124 0.82 KMT2A (0.48) MAPTMAPK1ALDH1A1RAB9AKMT2A
SCHEMBL1665686 0.82 MAOB (0.48) MAPTMAPK1ALDH1A1MAOBRAB9A
SCHEMBL1667338 0.82 MAOB (0.48) MAPTMAPK1ALDH1A1MAOBRAB9A

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 9 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
EP-2642994-A2 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS Ligand Pharmaceuticals Incorporated (US) 2013-10-02 EP disclosed
US-20120295904-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2012-11-22 US disclosed
EP-2488486-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES Ligand Pharmaceuticals Inc. (US) 2012-08-22 EP 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 4622/4885MAPK1 4003/4885ALDH1A1 3228/4885
US-20150252043-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF MAPT 4411/4885MAPK1 1482/4885ALDH1A1 2736/4885
US-20120295904-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF MAPT 4411/4885MAPK1 1482/4885ALDH1A1 2736/4885

“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.