SCHEMBL2895409

SCHEMBL2895409

CC(C)(C)Oc1ccc(C=Cc2cc[nH]c(=O)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN8A Q9UQD0 1/20 0.41
SCN10A Q9Y5Y9 1/20 0.41
IDH1 O75874 1/20 0.36
RELA Q04206 4/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.35
RAB9A P51151 1/20 0.35
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
TUBB4A P04350 3/20 0.35
TUBB P07437 3/20 0.35
TUBA3C P0DPH7 3/20 0.35
TUBA1B P68363 3/20 0.35
TUBA4A P68366 3/20 0.35
TUBB4B P68371 3/20 0.35
TUBB3 Q13509 3/20 0.35
TUBB2A Q13885 3/20 0.35
TUBB8 Q3ZCM7 3/20 0.35
TUBA3E Q6PEY2 3/20 0.35

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
SCHEMBL2895408 1.00 SCN8A (0.41) SCN8ASCN10AIDH1RELASMN1; SMN2
SCHEMBL2895412 0.75 NPC1 (0.43) SCN8ASCN10ARELASMN1; SMN2NPC1
SCHEMBL1002244 0.74 IP6K1 (0.53) MAOAMAOBNQO2ALOX5PTGS2
SCHEMBL1002245 0.74 IP6K1 (0.53) MAOAMAOBNQO2ALOX5PTGS2
SCHEMBL2881273 0.74 AHR (0.53) IDH1RELANPC1RAB9AMAPT
SCHEMBL2881271 0.74 AHR (0.53) IDH1RELANPC1RAB9AMAPT
SCHEMBL2881701 0.73 NOTUM (0.52) RELALMNAKDM4EMAOAMAOB
SCHEMBL2881704 0.73 NOTUM (0.52) RELALMNAKDM4EMAOAMAOB
SCHEMBL7541661 0.71 TRPA1 (0.61) RELASMN1; SMN2NPC1LMNARAB9A
SCHEMBL7541659 0.71 TRPA1 (0.61) RELASMN1; SMN2NPC1LMNARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7732456-B2 Pyridone derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-06-08 US disclosed
US-20070208046-A1 Pyridone derivative MSD K.K. (JP) 2007-09-06 US disclosed
EP-1741703-A1 PYRIDONE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-01-10 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 (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-20070208046-A1 Pyridone derivative CHRM1, XDH, MTR SCN8A 3532/4885SCN10A 2766/4885IDH1 864/4885

“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.