SCHEMBL1664635

SCHEMBL1664635

Nc1ccc2c(cnn2-c2ccc(C(=O)O)cc2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 1/20 0.53
PIM3 Q86V86 1/20 0.52
CHEK1 O14757 2/20 0.51
AURKA O14965 2/20 0.51
CSNK1A1 P48729 2/20 0.51
LIMK1 P53667 2/20 0.51
CLK4 Q9HAZ1 2/20 0.51
DAPK3 O43293 1/20 0.51
GSK3A P49840 1/20 0.51
IKBKE Q14164 1/20 0.51
MAPK14 Q16539 1/20 0.51
TAOK1 Q7L7X3 1/20 0.51
DYRK1B Q9Y463 1/20 0.51
XDH P47989 2/20 0.50
NPC1 O15118 1/20 0.50
HSP90AA1 P07900 1/20 0.50
NFKB1 P19838 1/20 0.50
RAB9A P51151 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50

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
SCHEMBL1666786 0.91 XDH (0.47) PLA2G10PIM3CHEK1AURKACSNK1A1
Isonicotinic Acid SCHEMBL27937036 0.91 PIM3 (0.47) PLA2G10PIM3CHEK1AURKACSNK1A1
SCHEMBL1667310 0.88 PLA2G10 (0.55) PLA2G10XDHNPC1HSP90AA1NFKB1
SCHEMBL13836680 0.87 CHEK1 (0.57) PLA2G10PIM3CHEK1AURKACSNK1A1
SCHEMBL13836976 0.85 CHEK1 (0.50) CHEK1AURKACSNK1A1LIMK1CLK4
SCHEMBL836441 0.83 PLA2G10 (0.53) PLA2G10XDHNPC1HSP90AA1NFKB1
SCHEMBL30127430 0.82 NR3C1 (0.54) CHEK1AURKACSNK1A1LIMK1CLK4
SCHEMBL21295429 0.82 NR3C1 (0.54) CHEK1AURKACSNK1A1LIMK1CLK4
SCHEMBL1664262 0.81 ALDH1A1 (0.61) CHEK1AURKACSNK1A1LIMK1CLK4
SCHEMBL2610311 0.81 MGLL (0.57) PLA2G10NPC1HSP90AA1NFKB1RAB9A

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 10 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
CN-103282034-A Use of hematopoietic growth factor mimetics LIGAND PHARM INC 2013-09-04 CN 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 PLA2G10 2918/4885PIM3 841/4885CHEK1 4509/4885
US-20150252043-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF PLA2G10 2591/4885PIM3 935/4885CHEK1 3260/4885
US-20120295904-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES MPL, CSF3R, HGF PLA2G10 2591/4885PIM3 935/4885CHEK1 3260/4885

“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.