SCHEMBL18632544

SCHEMBL18632544

Cc1ccc(C)c(-c2ccc3n[nH]c(=O)n3c2)c1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 1/20 0.47
NOTUM Q6P988 10/20 0.41
PIM1 P11309 1/20 0.41
SRC P12931 1/20 0.41
GSK3A P49840 1/20 0.41
LRRK2 Q5S007 1/20 0.40
PARP10 Q53GL7 1/20 0.38
ESRRA P11474 1/20 0.36
CHEK1 O14757 5/20 0.36

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
SCHEMBL30924244 0.89 SCN5A (0.47) SCN5ANOTUMPIM1SRCGSK3A
SCHEMBL10203097 0.82 SCN5A (0.61) SCN5ANOTUMPARP10CHEK1
SCHEMBL3435779 0.78 SCN5A (0.48) SCN5ANOTUMPARP10CHEK1
SCHEMBL18632511 0.74 LTK (0.55) SCN5ANOTUMPIM1LRRK2CHEK1
SCHEMBL18632513 0.71 SCN5A (0.49) SCN5ANOTUMLRRK2CHEK1
SCHEMBL18632535 0.71 SCN5A (0.62) SCN5ANOTUMPIM1LRRK2CHEK1
SCHEMBL18632530 0.71 SCN5A (0.62) SCN5ANOTUMPIM1LRRK2CHEK1
SCHEMBL18632537 0.70 SCN5A (0.48) SCN5ANOTUMPIM1LRRK2CHEK1
SCHEMBL18632536 0.70 SCN5A (0.51) SCN5ANOTUMGSK3ACHEK1
SCHEMBL20772418 0.70 CHEK1 (0.46) SCN5ANOTUMCHEK1

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-20170081323-A1 Triazolones derivatives for use in the treatment, amelioration or prevention of a viral disease HOFFMANN LA ROCHE (CH) 2017-03-23 US disclosed
US-20170081323-A1 Triazolones derivatives for use in the treatment, amelioration or prevention of a viral disease HOFFMANN LA ROCHE (CH) 2017-03-23 US disclosed
US-20170081323-A1 Triazolones derivatives for use in the treatment, amelioration or prevention of a viral disease HOFFMANN LA ROCHE (CH) 2017-03-23 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-20170081323-A1 Triazolones derivatives for use in the treatment, amelioration or prevention of a viral disease OAT, XDH, MAPT SCN5A 1311/4885NOTUM 541/4885PIM1 4523/4885

“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.