SCHEMBL22370975

SCHEMBL22370975

NCc1c(F)ccc(F)c1OCC1CC1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 6/20 0.38
▸ HTR2B P41595 4/20 0.38
▸ HTR2A P28223 2/20 0.38
▸ ALOX5AP P20292 1/20 0.36
▸ FEN1 P39748 1/20 0.36
▸ PARP10 Q53GL7 3/20 0.36
▸ PARP15 Q460N3 2/20 0.36
▸ PARP2 Q9UGN5 1/20 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
SCHEMBL30468374 1.00 HTR2C (0.38) HTR2CHTR2BHTR2AALOX5APFEN1
SCHEMBL22391549 0.79 RIPK1 (0.48) HTR2CHTR2BHTR2AALOX5APFEN1
SCHEMBL24180121 0.79 ALOX5AP (0.34) ALOX5APFEN1
SCHEMBL29786449 0.77 HTR2C (0.45) HTR2CHTR2BHTR2A
SCHEMBL20472458 0.77 HTR2C (0.45) HTR2CHTR2BHTR2A
SCHEMBL24018822 0.77 HTR2C (0.45) HTR2CHTR2BHTR2A
SCHEMBL22371226 0.77 MAOB (0.40) HTR2CHTR2BHTR2AALOX5APFEN1
SCHEMBL30468385 0.77 MAOB (0.40) HTR2CHTR2BHTR2AALOX5APFEN1
SCHEMBL24180091 0.72 FEN1 (0.41) HTR2CHTR2BHTR2AALOX5APFEN1
SCHEMBL24180249 0.72 FEN1 (0.41) ALOX5APFEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11440913-B2 Aminoimidazopyridazines as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2022-09-13 — — US disclosed
EP-3704118-B1 AMINOIMIDAZOPYRIDAZINES AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2022-01-12 — — EP disclosed
EP-3704118-A1 AMINOIMIDAZOPYRIDAZINES AS KINASE INHIBITORS Bristol-Myers Squibb Company (US) 2020-09-09 — — EP disclosed
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 (2 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-11440913-B2 Aminoimidazopyridazines as kinase inhibitors RIPK1, RIPK4, RIPK3 HTR2C 3194/4885HTR2B 3339/4885HTR2A 2621/4885
US-20200277296-A1 AMINOIMIDAZOPYRIDAZINES AS KINASE INHIBITORS RIPK1, RIPK4, RIPK3 HTR2C 3194/4885HTR2B 3339/4885HTR2A 2621/4885

“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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