SCHEMBL22389492

SCHEMBL22389492

CC(C)(C)Cc1c(F)cc(F)cc1OCC1CCCC1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 1/20 0.44
▸ SCN9A Q15858 10/20 0.38
▸ SCN5A Q14524 1/20 0.37
▸ HTR2A P28223 2/20 0.36
▸ HTR2C P28335 2/20 0.36
▸ HTR2B P41595 2/20 0.36
▸ PARP10 Q53GL7 2/20 0.36
▸ PARP15 Q460N3 1/20 0.34

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
SCHEMBL22390588 0.94 RIPK1 (0.50) RIPK1SCN9AHTR2AHTR2CHTR2B
SCHEMBL29786587 0.81 HTR2A (0.41) SCN9AHTR2AHTR2CHTR2BPARP10
SCHEMBL20472323 0.81 HTR2A (0.41) SCN9AHTR2AHTR2CHTR2BPARP10
SCHEMBL22957638 0.80 HTR2A (0.41) RIPK1SCN9ASCN5AHTR2AHTR2C
SCHEMBL22392368 0.79 RIPK1 (0.43) RIPK1SCN9AHTR2AHTR2CHTR2B
SCHEMBL22392048 0.79 RIPK1 (0.54) RIPK1HTR2CPARP10PARP15
SCHEMBL24018791 0.78 SCN9A (0.39) RIPK1SCN9ASCN5AHTR2AHTR2C
SCHEMBL22957828 0.78 SCN9A (0.39) RIPK1SCN9ASCN5AHTR2AHTR2C
SCHEMBL24018827 0.77 SCN9A (0.38) RIPK1SCN9ASCN5AHTR2AHTR2C
SCHEMBL22390570 0.76 RIPK1 (0.43) RIPK1HTR2AHTR2CHTR2BPARP10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200277296-A1 AMINOIMIDAZOPYRIDAZINES AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2020-09-03 — — 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-20200277296-A1 AMINOIMIDAZOPYRIDAZINES AS KINASE INHIBITORS RIPK1, RIPK4, RIPK3 RIPK1 1/4885SCN9A 2384/4885SCN5A 1593/4885

“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.

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