SCHEMBL3324955

SCHEMBL3324955

COc1cc(Cl)ccc1Oc1cc(Cl)ccc1OCC1CCCNC1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 6/20 0.53
HTR6 P50406 1/20 0.53
SLC6A2 P23975 4/20 0.43
SLC6A3 Q01959 4/20 0.43
CYP2D6 P10635 1/20 0.43
ACP1 P24666 1/20 0.42
HTR2C P28335 4/20 0.42
HTR2B P41595 4/20 0.42
KCNH2 Q12809 1/20 0.42
EED O75530 1/20 0.41
KIT P10721 1/20 0.41

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
SCHEMBL3329884 1.00 SLC6A4 (0.53) SLC6A4HTR6SLC6A2SLC6A3CYP2D6
SCHEMBL3324991 0.95 SLC6A4 (0.48) SLC6A4HTR6SLC6A2SLC6A3CYP2D6
SCHEMBL3326912 0.95 SLC6A4 (0.48) SLC6A4HTR6SLC6A2SLC6A3CYP2D6
SCHEMBL3324998 0.95 SLC6A4 (0.48) SLC6A4HTR6SLC6A2SLC6A3CYP2D6
SCHEMBL3325182 0.95 SLC6A4 (0.48) SLC6A4HTR6SLC6A2SLC6A3CYP2D6
SCHEMBL3325167 0.91 HTR2A (0.50) SLC6A4HTR6SLC6A2HTR2CHTR2B
SCHEMBL3325162 0.91 HTR2A (0.50) SLC6A4HTR6SLC6A2HTR2CHTR2B
SCHEMBL3324999 0.87 SLC6A4 (0.45) SLC6A4HTR6SLC6A2SLC6A3CYP2D6
SCHEMBL3324992 0.87 SLC6A4 (0.45) SLC6A4HTR6SLC6A2SLC6A3CYP2D6
SCHEMBL3323344 0.86 SLC6A4 (0.53) SLC6A4HTR6SLC6A2SLC6A3HTR2C

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
US-20100120858-A1 Piperidine Derivatives PFIZER INC. 2010-05-13 US claimed
EP-2066630-A1 PIPERIDINE DERIVATIVES Pfizer Products Incorporated (US) 2009-06-10 EP claimed
WO-2008023258-A1 PIPERIDINE DERIVATIVES PFIZER PRODUCTS INC. (US) 2008-02-28 WO claimed
US-20100120858-A1 Piperidine Derivatives PFIZER INC. 2010-05-13 US disclosed
EP-2066630-A1 PIPERIDINE DERIVATIVES Pfizer Products Incorporated (US) 2009-06-10 EP disclosed
WO-2008023258-A1 PIPERIDINE DERIVATIVES PFIZER PRODUCTS INC. (US) 2008-02-28 WO 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-20100120858-A1 Piperidine Derivatives P2RX5, P2RX7, P2RX1 SLC6A4 1898/4885HTR6 832/4885SLC6A2 2609/4885

“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.