SCHEMBL22389479

SCHEMBL22389479

CC(C)(C)Cc1cc(F)ccc1OC1CCCC1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NPY1R P25929 1/20 0.47
▸ NPY2R P49146 1/20 0.47
▸ SLC6A2 P23975 3/20 0.43
▸ PDE4A P27815 6/20 0.42
▸ RIPK1 Q13546 1/20 0.39
▸ CARM1 Q86X55 2/20 0.39
▸ PRMT1 Q99873 2/20 0.39
▸ CSNK2A1 P68400 2/20 0.38
▸ EPHX2 P34913 1/20 0.38
▸ PDE4B Q07343 3/20 0.38
▸ PDE4C Q08493 2/20 0.38
▸ PDE4D Q08499 2/20 0.38
▸ SLC6A4 P31645 2/20 0.37
▸ SLC6A3 Q01959 2/20 0.37
▸ RECQL P46063 1/20 0.37

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
SCHEMBL24180131 0.83 PDE4A (0.44) NPY1RNPY2RPDE4ACARM1PRMT1
SCHEMBL22957846 0.82 NPY1R (0.70) NPY1RNPY2RPDE4ARIPK1EPHX2
SCHEMBL22390612 0.81 RIPK1 (0.58) NPY1RNPY2RSLC6A2PDE4ARIPK1
SCHEMBL29786553 0.80 CSNK2A1 (0.51) NPY1RNPY2RSLC6A2PDE4ACARM1
SCHEMBL20472386 0.80 CSNK2A1 (0.51) NPY1RNPY2RSLC6A2PDE4ACARM1
SCHEMBL22391953 0.80 RIPK1 (0.61) SLC6A2RIPK1SLC6A4
SCHEMBL24180134 0.79 PDE4A (0.47) NPY1RNPY2RSLC6A2PDE4APDE4B
SCHEMBL22957683 0.79 SLC6A4 (0.54) NPY1RNPY2RSLC6A2PDE4ACARM1
SCHEMBL22957878 0.79 NPY1R (0.56) NPY1RNPY2RPDE4ARIPK1EPHX2
SCHEMBL12775726 0.77 KDM4E (0.45) SLC6A2SLC6A4SLC6A3

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 NPY1R 4215/4885NPY2R 4585/4885SLC6A2 4695/4885

“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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