SCHEMBL1504561

SCHEMBL1504561

Cn1ccc(NC(=O)c2ccc(Cl)c(NC(=O)c3ccc(=O)n(-c4c(Cl)cccc4Cl)c3)c2)n1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.50
RAB9A P51151 4/20 0.50
MAPK8 P45983 1/20 0.49
MAPK10 P53779 1/20 0.49
MAPK7 Q13164 1/20 0.41
MAPT P10636 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HDAC1 Q13547 2/20 0.41
HDAC8 Q9BY41 2/20 0.41
HDAC6 Q9UBN7 2/20 0.41
LMNA P02545 1/20 0.40
F10 P00742 1/20 0.39
TP53 P04637 1/20 0.39
RPS6KA3 P51812 1/20 0.39
RPS6KA2 Q15349 1/20 0.39

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
SCHEMBL1504401 0.92 NPC1 (0.47) NPC1RAB9AMAPK8MAPK10MAPK7
SCHEMBL1504516 0.82 SMN1; SMN2 (0.52) RAB9ASMN1; SMN2HDAC1HDAC8HDAC6
SCHEMBL1504505 0.81 HDAC1 (0.48) NPC1RAB9AMAPTSMN1; SMN2HDAC1
SCHEMBL1504532 0.81 NPC1 (0.51) NPC1RAB9AMAPK8MAPK10MAPT
SCHEMBL1504713 0.81 HDAC1 (0.46) SMN1; SMN2HDAC1HDAC8HDAC6LMNA
SCHEMBL1504004 0.81 MAPK8 (0.50) NPC1RAB9AMAPK8MAPK10MAPT
SCHEMBL1504536 0.81 CYP1A2 (0.53) MAPTSMN1; SMN2HDAC1HDAC8HDAC6
SCHEMBL1504645 0.80 NPC1 (0.47) NPC1RAB9AMAPK8MAPK10MAPK7
SCHEMBL1504630 0.78 KDM4E (0.52) MAPTHDAC1HDAC8HDAC6F10
SCHEMBL1504540 0.78 NPC1 (0.52) NPC1MAPTSMN1; SMN2LMNAF10

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8173684-B2 Pyridone derivatives as p38α MAPK inhibitors ASTELLAS PHARMA INC. (JP) 2012-05-08 US disclosed
US-8173684-B2 Pyridone derivatives as p38α MAPK inhibitors ASTELLAS PHARMA INC. (JP) 2012-05-08 US disclosed
US-8173684-B2 Pyridone derivatives as p38α MAPK inhibitors ASTELLAS PHARMA INC. (JP) 2012-05-08 US disclosed
EP-2155683-B1 PYRIDONE DERIVATIVES AS P38A MAPK INHIBITORS ASTELLAS PHARMA INC (JP) 2011-03-16 EP disclosed
US-20100063098-A1 PYRIDONE DERIVATIVES AS P38A MAPK INHIBITORS ASTELLAS PHARMA INC. (JP) 2010-03-11 US disclosed
US-20100063098-A1 PYRIDONE DERIVATIVES AS P38A MAPK INHIBITORS ASTELLAS PHARMA INC. (JP) 2010-03-11 US disclosed
US-20100063098-A1 PYRIDONE DERIVATIVES AS P38A MAPK INHIBITORS ASTELLAS PHARMA INC. (JP) 2010-03-11 US 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 (1 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-20100063098-A1 PYRIDONE DERIVATIVES AS P38A MAPK INHIBITORS MAPK1, MAPK6, MAPK3 NPC1 4090/4885RAB9A 1797/4885MAPK8 22/4885

“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.