SCHEMBL22957684

SCHEMBL22957684

CC(C)NCc1cc(F)ccc1OC1CCCC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.56
▸ NPY1R P25929 1/20 0.48
▸ NPY2R P49146 1/20 0.48
▸ PDE4A P27815 3/20 0.43
▸ KCNH2 Q12809 2/20 0.43
▸ NTRK1 P04629 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ PDE4B Q07343 1/20 0.40
▸ PDE4C Q08493 1/20 0.40
▸ PDE4D Q08499 1/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ MAPT P10636 1/20 0.40
▸ RIPK1 Q13546 2/20 0.39
▸ TACR1 P25103 1/20 0.39
▸ KDM1A O60341 1/20 0.39
▸ MAOA P21397 1/20 0.39
▸ MAOB P27338 1/20 0.39
▸ PTGDR Q13258 1/20 0.39
▸ HTR2A P28223 1/20 0.39

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
SCHEMBL22957683 0.86 SLC6A4 (0.54) NPY1RNPY2RPDE4AKCNH2NTRK1
SCHEMBL24180134 0.83 PDE4A (0.47) LMNANPY1RNPY2RPDE4APDE4B
SCHEMBL22957692 0.82 LMNA (0.54) LMNANPY1RNPY2RMEN1KMT2A
SCHEMBL22957846 0.82 NPY1R (0.70) LMNANPY1RNPY2RPDE4AKCNH2
SCHEMBL24180131 0.81 PDE4A (0.44) NPY1RNPY2RPDE4APDE4BPDE4C
SCHEMBL14012652 0.81 KCNH2 (0.52) LMNAKCNH2NTRK1TACR1KDM1A
SCHEMBL22957878 0.79 NPY1R (0.56) LMNANPY1RNPY2RPDE4AKCNH2
SCHEMBL20472386 0.78 CSNK2A1 (0.51) NPY1RNPY2RPDE4ASLC6A4
SCHEMBL29786553 0.78 CSNK2A1 (0.51) NPY1RNPY2RPDE4ASLC6A4
SCHEMBL18783703 0.78 NPY1R (0.41) LMNANPY1RNPY2RPDE4APDE4B

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-10913738-B2 Aminotriazolopyridines as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2021-02-09 — — 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-10913738-B2 Aminotriazolopyridines as kinase inhibitors RIPK1, RIPK3, RIPK4 LMNA 3449/4885NPY1R 2919/4885NPY2R 3582/4885

“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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