SCHEMBL949495

SCHEMBL949495

CN1CCN(c2ccc3[nH]c(-c4cc(NC(=O)c5cnn(Cc6ccc(F)cc6)c5)c[nH]c4=O)cc3c2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.47
MAPT P10636 2/20 0.47
NTRK1 P04629 6/20 0.40
DYRK1A Q13627 3/20 0.40
CLK1 P49759 1/20 0.40
SMN1; SMN2 Q16637 4/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
LMNA P02545 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
POLB P06746 1/20 0.39
MAPK1 P28482 1/20 0.39
AURKA O14965 1/20 0.39
INSR P06213 1/20 0.39
IGF1R P08069 1/20 0.39
AURKB Q96GD4 1/20 0.39
ALK Q9UM73 1/20 0.39
KIT P10721 1/20 0.38
CHEK1 O14757 3/20 0.38
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL949062 0.94 HPGD (0.40) HPGDMAPTNTRK1SMN1; SMN2L3MBTL1
SCHEMBL949960 0.93 RPS6KA2 (0.42) HPGDMAPTSMN1; SMN2L3MBTL1MEN1
SCHEMBL949831 0.85 CHEK1 (0.50) CHEK1
SCHEMBL13770545 0.85 KDR (0.36) HPGDMAPTDYRK1ACLK1SMN1; SMN2
SCHEMBL952524 0.84 CHEK1 (0.48) NTRK1INSRALKCHEK1
SCHEMBL12946245 0.84 CHEK1 (0.48) NTRK1INSRALKCHEK1
SCHEMBL952388 0.84 CHEK1 (0.48) NTRK1INSRALKCHEK1
SCHEMBL948091 0.84 ALDH1A1 (0.41) MAPTDYRK1ASMN1; SMN2L3MBTL1LMNA
SCHEMBL951302 0.84 RAB9A (0.41) MAPTSMN1; SMN2LMNAMAPK1CHEK1
SCHEMBL948391 0.84 CHEK1 (0.46) CHEK1

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-20200361905-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity VERNALIS R&D LTD (GB) 2020-11-19 US disclosed
US-10696652-B2 Indolyl-pyridone derivatives having checkpoint kinase 1 inhibitory activity VERNALIS (R&D) LTD. (GB) 2020-06-30 US disclosed
US-20170298043-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity VERNALIS (R&D) LTD. (GB) 2017-10-19 US disclosed
US-9604975-B2 Indolyl-pyridone derivatives having checkpoint kinase 1 inhibitory activity VERNALIS (R&D) LTD (GB) 2017-03-28 US disclosed
US-20150099736-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity VERNALIS (R&D) LTD (GB) 2015-04-09 US disclosed
US-8916591-B2 Indolyl-pyridone derivatives having checkpoint kinase 1 inhibitory activity VERNALIS (R&D) LTD (GB) 2014-12-23 US disclosed
EP-2294065-B1 INDOLYL-PYRIDONE DERIVATIVES HAVING CHECKPOINT KINASE 1 INHIBITORY ACTIVITY VERNALIS R&D LTD (GB) 2014-03-19 EP disclosed
US-20110021498-A1 INDOLYL- PYRIDONE DERIVATIVES HAVING CHECKPOINT KINASE 1 INHIBITORY ACTIVITY VERNALIS (R & D) LTD (GB) 2011-01-27 US disclosed
US-20110021498-A1 INDOLYL- PYRIDONE DERIVATIVES HAVING CHECKPOINT KINASE 1 INHIBITORY ACTIVITY VERNALIS (R & D) LTD (GB) 2011-01-27 US disclosed
WO-2009093012-A1 INDOLYL- PYRIDONE DERIVATIVES HAVING CHECKPOINT KINASE 1 INHIBITORY ACTIVITY VERNALIS (R & D) LTD (GB) 2009-07-30 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 (5 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-20170298043-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity CHEK1, CHEK2, RAD1 HPGD 2640/4885MAPT 4198/4885NTRK1 41/4885
US-20200361905-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity CHEK2, CHEK1, BUB1B HPGD 2402/4885MAPT 2482/4885NTRK1 485/4885
US-20150099736-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity CHEK1, CHEK2, RAD1 HPGD 2640/4885MAPT 4198/4885NTRK1 41/4885
US-10696652-B2 Indolyl-pyridone derivatives having checkpoint kinase 1 inhibitory activity CHEK2, CHEK1, BUB1B HPGD 2402/4885MAPT 2482/4885NTRK1 485/4885
US-20110021498-A1 INDOLYL- PYRIDONE DERIVATIVES HAVING CHECKPOINT KINASE 1 INHIBITORY ACTIVITY CHEK1, CHEK2, BUB1 HPGD 2246/4885MAPT 4536/4885NTRK1 165/4885

“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.