SCHEMBL14354382

SCHEMBL14354382

CC(O)(CCN1CCCCC1)c1ccccc1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 6/20 0.71
CHRM2 P08172 6/20 0.71
CHRM1 P11229 6/20 0.71
KCNH2 Q12809 4/20 0.71
HTR1A P08908 3/20 0.71
OPRM1 P35372 3/20 0.71
LMNA P02545 2/20 0.71
MAPK1 P28482 2/20 0.62
MEN1 O00255 1/20 0.62
KMT2A Q03164 1/20 0.62
CHRM3 P20309 5/20 0.62
CHRM4 P08173 4/20 0.62
CHRM5 P08912 4/20 0.62
SIGMAR1 Q99720 2/20 0.62
KDM4E B2RXH2 1/20 0.62
DRD2 P14416 1/20 0.62
DRD1 P21728 1/20 0.62
HTR2A P28223 1/20 0.62
DRD3 P35462 1/20 0.62
SCN1A P35498 1/20 0.62

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
SCHEMBL11487380 0.91 CYP2D6 (0.59) CYP2D6CHRM2CHRM1KCNH2HTR1A
SCHEMBL8967625 0.90 CHRM2 (0.72) CYP2D6CHRM2CHRM1KCNH2HTR1A
SCHEMBL11489480 0.89 CYP2D6 (0.56) CYP2D6CHRM2CHRM1KCNH2HTR1A
SCHEMBL11495711 0.87 ALDH1A1 (0.55) CYP2D6CHRM2CHRM1KCNH2HTR1A
SCHEMBL11487164 0.87 ALDH1A1 (0.55) CYP2D6CHRM2CHRM1KCNH2HTR1A
SCHEMBL11489338 0.85 LTA4H (0.55) CYP2D6CHRM2CHRM1KCNH2HTR1A
SCHEMBL14354524 0.83 CHRM2 (0.56) CYP2D6CHRM2CHRM1KCNH2HTR1A
Pridinol SCHEMBL143298 0.83 CHRM2 (1.00) CYP2D6CHRM2CHRM1KCNH2HTR1A
SCHEMBL11492973 0.82 KCNH2 (0.61) CYP2D6CHRM2CHRM1KCNH2HTR1A
Pridinol SCHEMBL363996 0.81 CHRM2 (0.97) CYP2D6CHRM2CHRM1KCNH2HTR1A

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
US-8957081-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2015-02-17 US claimed
US-20130005748-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2013-01-03 US claimed

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-20130005748-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS ZAP70, IGF1R, PTK2 CYP2D6 4747/4885CHRM2 3610/4885CHRM1 3271/4885

“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.