SCHEMBL6497571

SCHEMBL6497571

OC1CCN(Cc2ccccc2)C(c2ccc(Cl)cc2)C1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CFB P00751 2/20 0.47
GBA1 P04062 1/20 0.45
SIGMAR1 Q99720 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
RORC P51449 1/20 0.43
ALDH1A1 P00352 2/20 0.43
DRD2 P14416 1/20 0.42
DRD4 P21917 1/20 0.42
DRD3 P35462 1/20 0.42
MAPT P10636 1/20 0.40
CHRM2 P08172 2/20 0.40
CHRM3 P20309 2/20 0.40
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
BACE1 P56817 1/20 0.40

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
SCHEMBL3890628 0.89 CFB (0.47) CFBGBA1SIGMAR1ALDH1A1MAPT
SCHEMBL6042431 0.88 CFB (0.47) CFBGBA1SIGMAR1RORCALDH1A1
SCHEMBL3901486 0.85 NPC1 (0.45) CFBGBA1
SCHEMBL7407486 0.85 CCR3 (0.46) GBA1SIGMAR1MEN1KMT2A
SCHEMBL3893163 0.81 GBA1 (0.43) CFBGBA1SIGMAR1RORC
SCHEMBL14563099 0.81 RORC (0.42) SIGMAR1MEN1KMT2ARORCALDH1A1
SCHEMBL21625238 0.80 MEN1 (0.50) CFBMEN1KMT2AALDH1A1MAPT
SCHEMBL30768210 0.80 MEN1 (0.50) CFBMEN1KMT2AALDH1A1MAPT
SCHEMBL23064641 0.80 DRD2 (0.54) SIGMAR1MEN1KMT2ARORCALDH1A1
SCHEMBL3034824 0.80 DRD2 (0.47) CFBGBA1SIGMAR1RORCDRD2

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-20050143372-A1 Compounds, pharmaceutical compositions and methods of use therefor MILLENNIUM PHARMACEUTICALS, INC. 2005-06-30 US disclosed
WO-2003037271-A2 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE THEREFOR MILLENNIUM PHARMACEUTICALS,INC. (US) 2003-05-08 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-20050143372-A1 Compounds, pharmaceutical compositions and methods of use therefor CCR8, CCL11, CCR5 CFB 524/4885GBA1 876/4885SIGMAR1 525/4885

“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.