SCHEMBL6765181

SCHEMBL6765181

CC(=O)c1cc(Cl)ccc1OCC(=O)N1[C@@H]2CC[C@H]1CC(Oc1ccc(F)cc1)C2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
ALDH1A1 P00352 2/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CCR1 P32246 6/20 0.45
TSHR P16473 1/20 0.43
EPHX2 P34913 1/20 0.40
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NAAA Q02083 1/20 0.38
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.38
FPR3 P25089 1/20 0.37
GPR65 Q8IYL9 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
SCHEMBL6765183 1.00 NPC1 (0.47) NPC1RAB9AALDH1A1HTTSMN1; SMN2
SCHEMBL6762010 0.91 CCR1 (0.52) CCR1TSHREPHX2LMNATP53
SCHEMBL6762007 0.91 CCR1 (0.52) CCR1TSHREPHX2LMNATP53
SCHEMBL6758368 0.91 CCR1 (0.43) NPC1RAB9ACCR1TSHREPHX2
SCHEMBL6156266 0.91 CCR1 (0.43) NPC1RAB9ACCR1TSHREPHX2
SCHEMBL6156258 0.91 CCR1 (0.43) NPC1RAB9ACCR1TSHREPHX2
SCHEMBL6765200 0.90 CCR1 (0.44) NPC1RAB9AALDH1A1CCR1TSHR
SCHEMBL6765196 0.90 CCR1 (0.44) NPC1RAB9AALDH1A1CCR1TSHR
SCHEMBL6758359 0.87 TSHR (0.43) ALDH1A1HTTCCR1TSHREPHX2
SCHEMBL6758352 0.87 TSHR (0.43) ALDH1A1HTTCCR1TSHREPHX2

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-20040063688-A1 Novel piperidine derivatives PFIZER INC. 2004-04-01 US claimed
US-20040063688-A1 Novel piperidine derivatives PFIZER INC. 2004-04-01 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-20040063688-A1 Novel piperidine derivatives CCR1, CCR3, CCR2 NPC1 1059/4885RAB9A 1404/4885ALDH1A1 1323/4885

“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.