SCHEMBL22390621

SCHEMBL22390621

CC(C)(C)Cc1ccccc1OCC1CCC(F)(F)CC1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 3/20 0.76
▸ SCN9A Q15858 5/20 0.38
▸ HTR2C P28335 3/20 0.36
▸ SCN5A Q14524 2/20 0.36
▸ SLC6A2 P23975 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ SLC6A3 Q01959 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ RBP4 P02753 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ ADRA1D P25100 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ ADRA1A P35348 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
SCHEMBL22391510 0.87 RIPK1 (1.00) RIPK1HTR2CSLC6A2SLC6A4SLC6A3
SCHEMBL24018847 0.85 RIPK1 (0.52) RIPK1SCN9ASCN5ASLC6A2SLC6A4
SCHEMBL22391548 0.84 RIPK1 (0.88) RIPK1HTR2CSLC6A2SLC6A4SLC6A3
SCHEMBL22390530 0.84 RIPK1 (0.88) RIPK1HTR2CSLC6A2SLC6A4SLC6A3
SCHEMBL20472331 0.82 RIPK1 (0.49) RIPK1SCN9AHTR2CSCN5ASLC6A2
SCHEMBL29786503 0.82 RIPK1 (0.49) RIPK1SCN9AHTR2CSCN5ASLC6A2
SCHEMBL18014773 0.81 RIPK1 (0.49) RIPK1LRRK2KDM5AKDM4CKDM5B
SCHEMBL22393284 0.74 RIPK1 (0.70) RIPK1HTR2CRBP4MEN1TP53
SCHEMBL561124 0.73 RIPK1 (0.63) RIPK1HTR2CSLC6A2SLC6A4SLC6A3
SCHEMBL24968803 0.71 MCHR1 (0.42) RIPK1SCN9AHTR2CSCN5AKDM5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3704118-B1 AMINOIMIDAZOPYRIDAZINES AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2022-01-12 — — 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 (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 2384/4885HTR2C 3194/4885

“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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