SCHEMBL6166906

SCHEMBL6166906

CC(F)(CC[C@H](C[C@@H](O)[CH]Cc1ccccc1)c1ncc[nH]1)C(N)=O

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
POLB P06746 1/20 0.33
CSNK1A1 P48729 1/20 0.33
TYRO3 Q06418 1/20 0.33
DYRK1B Q9Y463 1/20 0.33
FPR2 P25090 2/20 0.32
CCR1 P32246 1/20 0.31
F2RL1 P55085 6/20 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
SCHEMBL6167991 0.92 ADRA2A (0.33) ADRA2AADRA2BADRA2CPOLBCSNK1A1
SCHEMBL6167131 0.90 F2RL1 (0.36) CCR1F2RL1
SCHEMBL6168666 0.86
SCHEMBL6167961 0.85 CCR1 (0.31) CCR1
SCHEMBL6168251 0.84 CCR1 (0.30) CCR1
SCHEMBL6167917 0.83 F2RL1 (0.35) CCR1F2RL1
SCHEMBL6168083 0.83 F2RL1 (0.35) CCR1F2RL1
SCHEMBL6168214 0.83 CTSA (0.34) POLBCCR1
SCHEMBL6167169 0.82 MAOA (0.38) ADRA2AADRA2BADRA2CPOLB
SCHEMBL6168206 0.80 ACKR3 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 ADRA2A 1853/4885ADRA2B 1476/4885ADRA2C 1614/4885

“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.