SCHEMBL6168934

SCHEMBL6168934

CC(O)(CC[C@H](C[C@@H](O)[CH]Cc1cccc(F)c1)S(N)(=O)=O)C(N)=O

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 3/20 0.36
CHRM2 P08172 1/20 0.36
CCR5 P51681 1/20 0.36
VNN1 O95497 1/20 0.34
RIPK1 Q13546 1/20 0.32
SLC1A1 P43005 2/20 0.32
LTB4R Q15722 1/20 0.32
LTB4R2 Q9NPC1 1/20 0.32
MAOB P27338 3/20 0.31
MAOA P21397 2/20 0.31
KCNN4 O15554 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
CHRM1 P11229 1/20 0.31
PARP10 Q53GL7 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
SCN9A Q15858 1/20 0.31

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
SCHEMBL6165913 0.92 CCR1 (0.34) CCR1CHRM2CCR5VNN1RIPK1
SCHEMBL6167185 0.88 MEN1 (0.33) CCR1
SCHEMBL3825742 0.87 CCR1 (0.44) CCR1CHRM2CCR5VNN1RIPK1
SCHEMBL2675741 0.87 CCR1 (0.44) CCR1CHRM2CCR5VNN1RIPK1
SCHEMBL6169055 0.81 MEN1 (0.32) CCR1
SCHEMBL2675451 0.79 CCR1 (0.42) CCR1CHRM2CCR5VNN1RIPK1
SCHEMBL27608396 0.79 CCR1 (0.51) CCR1CHRM2CCR5VNN1RIPK1
SCHEMBL7688420 0.79 CCR1 (0.51) CCR1CHRM2CCR5VNN1RIPK1
SCHEMBL6166473 0.78 CCR1 (0.37) CCR1CHRM2CCR5VNN1HPGD
SCHEMBL6167917 0.78 F2RL1 (0.35) CCR1CHRM2CCR5VNN1

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-1498417-A1 Heterocyclic amide derivatives Pfizer Products Inc. (US) 2005-01-19 EP claimed
US-6548671-B2 Treating autoimmune diseases, inflammatory conditions, allergies, infections, viral diseases, bronchitis, transplant tissue rejection, atherosclerosis, restenosis, HIV infectivity, and granulomatous PFIZER INC 2003-04-15 US claimed
US-20020132810-A1 Novel heterocyclic amide derivatives BROWN MATTHEW F (US) 2002-09-19 US claimed
EP-1498417-A1 Heterocyclic amide derivatives Pfizer Products Inc. (US) 2005-01-19 EP disclosed
US-6548671-B2 Treating autoimmune diseases, inflammatory conditions, allergies, infections, viral diseases, bronchitis, transplant tissue rejection, atherosclerosis, restenosis, HIV infectivity, and granulomatous PFIZER INC 2003-04-15 US disclosed
US-20020132810-A1 Novel heterocyclic amide derivatives BROWN MATTHEW F (US) 2002-09-19 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-20020132810-A1 Novel heterocyclic amide derivatives ARG1, IL4, ARG2 CCR1 32/4885CHRM2 3307/4885CCR5 160/4885

“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.