SCHEMBL11047280

SCHEMBL11047280

CCOC(=O)N1CCC(Nc2ccc(F)cc2)(C(N)=O)CC1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.48
ALDH1A1 P00352 2/20 0.48
HTT P42858 1/20 0.48
KDM4E B2RXH2 1/20 0.48
GAA P10253 1/20 0.48
ABL1 P00519 1/20 0.48
POLB P06746 1/20 0.48
RIN1 Q13671 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
TRPC6 Q9Y210 1/20 0.45
OPRD1 P41143 1/20 0.45
RAB9A P51151 1/20 0.43
NPC1 O15118 1/20 0.43
CYP2C19 P33261 2/20 0.43
MEN1 O00255 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
KMT2A Q03164 1/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL5067988 0.88 MAPT (0.56) MAPTALDH1A1GAAABL1POLB
SCHEMBL14160410 0.81 MAPT (0.48) MAPTALDH1A1HTTKDM4EGAA
SCHEMBL11046085 0.80 MAPT (0.47) MAPTALDH1A1HTTKDM4EGAA
SCHEMBL11569029 0.77 MAPT (0.63) MAPTALDH1A1KDM4EGAAABL1
SCHEMBL800531 0.76 MAPT (0.58) MAPTALDH1A1KDM4EGAAABL1
SCHEMBL11568412 0.75 MAPT (0.56) MAPTALDH1A1KDM4EGAAABL1
SCHEMBL780425 0.74 MAPT (0.62) MAPTALDH1A1KDM4EGAAABL1
SCHEMBL13422387 0.74 CA12 (0.51) MAPTALDH1A1POLBOPRD1MEN1
SCHEMBL5556286 0.73 ALDH1A1 (0.61) ALDH1A1OPRD1
SCHEMBL17140741 0.72 FPR2 (0.50) MAPTALDH1A1HTTRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2102206-B1 SALTS OF 3-(3-AMINO-2-(R)-HYDROXY-PROPYL)-1-(4-FLUORO-PHENYL)-8-(8-METHYL-NAPHTHALEN-1-YLMETHYL)-1,3,8-TRIAZA-SPIRO[4.5]DECAN-4-ONE JANSSEN PHARMACEUTICA NV (BE) 2015-04-08 EP disclosed
US-8703948-B2 Salts of 3-(3-amino-2-(R)-hydroxy-propyl)-1-(4-fluoro-phenyl)-8-(8-methyl-naphthalen-1-ylmethyl)-1,3,8-triaza-spiro[4.5]decan-4-one JANSSEN PHARMACEUTICA NV (BE) 2014-04-22 US disclosed
US-20080176882-A1 SALTS OF 3-(3-AMINO-2-(R)-HYDROXY-PROPYL)-1-(4-FLUORO-PHENYL)-8-(8-METHYL-NAPHTHALEN-1-YLMETHYL)-1,3,8-TRIAZA-SPIRO[4.5]DECAN-4-ONE JANSSEN PHARMACEUTICA N.V. (BE) 2008-07-24 US disclosed
EP-0035902-B1 1-(4-ARYL-CYCLOHEXYL)PIPERIDINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1984-10-31 EP disclosed
US-4329353-A ANTIEMETIC AND NEUROLEPTIC AGENTS JANSSEN PHARMACEUTICA, N.V. (BE) 1982-05-11 US disclosed
EP-0035902-A1 1-(4-Aryl-cyclohexyl)piperidine derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1981-09-16 EP 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-20080176882-A1 SALTS OF 3-(3-AMINO-2-(R)-HYDROXY-PROPYL)-1-(4-FLUORO-PHENYL)-8-(8-METHYL-NAPHTHALEN-1-YLMETHYL)-1,3,8-TRIAZA-SPIRO[4.5]DECAN-4-ONE HTR1A, NR3C1, HTR4 MAPT 772/4885ALDH1A1 134/4885HTT 417/4885

“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.