SCHEMBL7094627

SCHEMBL7094627

O=C(CCl)N1C2CCC1CN(Cc1ccc(F)cc1)C2

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 4/20 0.47
S1PR5 Q9H228 1/20 0.46
PRKAA2 P54646 1/20 0.43
HTR2A P28223 1/20 0.43
SIGMAR1 Q99720 3/20 0.42
SLC6A12 P48065 1/20 0.42
TMEM97 Q5BJF2 1/20 0.42
MCHR1 Q99705 1/20 0.42
MLNR O43193 1/20 0.42
CYP3A4 P08684 1/20 0.42

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
SCHEMBL5242254 0.89 S1PR5 (0.44) CCR1S1PR5PRKAA2HTR2A
SCHEMBL6995970 0.89 CCR1 (0.47) CCR1S1PR5HTR2ASIGMAR1MLNR
SCHEMBL18446002 0.85 S1PR5 (0.51) CCR1S1PR5HTR2ASIGMAR1
SCHEMBL6994339 0.83 CCR1 (0.48) CCR1S1PR5MLNRCYP3A4
SCHEMBL5241550 0.81 CCR1 (0.53) CCR1S1PR5HTR2ASIGMAR1
SCHEMBL5240096 0.80 TP53 (0.41) S1PR5MLNRCYP3A4
SCHEMBL18418205 0.78 KCNK3 (0.48) CCR1S1PR5
SCHEMBL6993588 0.74 CCR1 (0.48) CCR1
SCHEMBL7000591 0.73 CCR1 (0.62) CCR1S1PR5
SCHEMBL7000018 0.73 CCR1 (0.53) CCR1S1PR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1326867-A2 BRIDGED PIPERAZINE DERIVATIVES Pfizer Products Inc. (US) 2003-07-16 EP disclosed
US-20020119961-A1 Bridged piperazine derivatives PFIZER INC. 2002-08-29 US disclosed
WO-2002032901-A2 BRIDGED PIPERAZINE DERIVATIVES PFIZER PRODUCTS INC. (US) 2002-04-25 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-20020119961-A1 Bridged piperazine derivatives MYD88, IL4, ARG1 CCR1 7/4885S1PR5 288/4885PRKAA2 4317/4885

“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.