SCHEMBL1663106

SCHEMBL1663106

Nc1ccc2nc(Nc3ccccc3)[nH]c2c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.68
KMT2A Q03164 5/20 0.68
RIPK1 Q13546 1/20 0.60
GAA P10253 7/20 0.56
MAPT P10636 5/20 0.56
KDM4E B2RXH2 4/20 0.56
RAB9A P51151 4/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
ALDH1A1 P00352 3/20 0.56
NPC1 O15118 3/20 0.56
HPGD P15428 2/20 0.56
GLA P06280 2/20 0.56
GFER P55789 2/20 0.56
HTT P42858 1/20 0.56
RCE1 Q9Y256 1/20 0.56
CSNK1A1 P48729 3/20 0.56
CSNK1D P48730 3/20 0.56
GSK3B P49841 2/20 0.56
CSNK1G2 P78368 2/20 0.56
PKM P14618 2/20 0.51

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
SCHEMBL1663100 0.88 MEN1 (0.68) MEN1KMT2ARIPK1GAAMAPT
SCHEMBL2893250 0.85 MEN1 (0.60) MEN1KMT2ARIPK1GAAMAPT
SCHEMBL9718864 0.84 RIPK1 (0.63) MEN1KMT2ARIPK1MAPTRAB9A
SCHEMBL18236211 0.81 ADORA2A (0.64) MEN1KMT2ARIPK1MAPTKDM4E
SCHEMBL1663437 0.81 MEN1 (0.57) MEN1KMT2AGAAMAPTKDM4E
SCHEMBL20685416 0.81 MEN1 (1.00) MEN1KMT2AGAAMAPTKDM4E
SCHEMBL32666096 0.81 MEN1 (0.59) MEN1KMT2ARIPK1GAAMAPT
SCHEMBL239690 0.80 MEN1 (0.75) MEN1KMT2ARIPK1GAAMAPT
SCHEMBL30020996 0.80 MEN1 (0.75) MEN1KMT2ARIPK1GAAMAPT
SCHEMBL29986068 0.79 CSNK1D (0.85) MEN1KMT2ARIPK1CSNK1A1CSNK1D

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-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
EP-0419210-B1 Novel benzimidazole compounds and their use PFIZER (US) 1994-11-02 EP disclosed
US-5141950-A Enzyme inhibitors; treating asthma; antiarthritic agent PFIZER INC. (US) 1992-08-25 US disclosed
EP-0419210-A1 Novel benzimidazole compounds and their use PFIZER INC. (US) 1991-03-27 EP 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 MEN1 1370/4885KMT2A 2225/4885RIPK1 3796/4885
US-20150252043-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF MEN1 1395/4885KMT2A 806/4885RIPK1 2219/4885
US-20120295904-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF MEN1 1395/4885KMT2A 806/4885RIPK1 2219/4885

“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.