SCHEMBL6285546

SCHEMBL6285546

CCN(C(=O)c1ccc2c(c1)ncn2C[C@H](C)O)N(C)C

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F10 P00742 2/20 0.42
HCAR3 P49019 1/20 0.41
HPGD P15428 4/20 0.41
APAF1 O14727 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
F2 P00734 1/20 0.40
PRSS1 P07477 1/20 0.40
MAPT P10636 2/20 0.40
LMNA P02545 2/20 0.40
POLB P06746 1/20 0.39
PPARG P37231 4/20 0.38
FGFR1 P11362 1/20 0.38
ALDH1A1 P00352 2/20 0.37

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
SCHEMBL6281552 0.84 FGFR1 (0.52) F10HCAR3HPGDAPAF1NPC1
SCHEMBL6277706 0.78 RIPK1 (0.49) F10HCAR3HPGDAPAF1NPC1
SCHEMBL6175661 0.78 RIPK1 (0.49) F10HCAR3HPGDAPAF1NPC1
SCHEMBL6285544 0.76 ALDH1A1 (0.51) HPGDLMNAPOLBALDH1A1
SCHEMBL6243442 0.72 ALDH1A1 (0.46) HCAR3HPGDALDH1A1
SCHEMBL6285122 0.72 POLB (0.45) APAF1NPC1RAB9AMAPTLMNA
SCHEMBL6176590 0.72 POLB (0.45) APAF1NPC1RAB9AMAPTLMNA
SCHEMBL20985903 0.72 MAPT (0.60) F10APAF1MAPTLMNAPOLB
SCHEMBL6283673 0.72 POLB (0.45) APAF1MAPTLMNAPOLBPPARG
SCHEMBL6112712 0.70 NPC1 (0.62) F10HCAR3HPGDNPC1RAB9A

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-6875765-B2 Arylsulfonamide ethers, and methods of use thereof WARNER-LAMBERT COMPANY (US) 2005-04-05 US disclosed
US-20030096826-A1 Arylsulfonamide ethers, and methods of use thereof WARNER-LAMBERT COMPANY 2003-05-22 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-20030096826-A1 Arylsulfonamide ethers, and methods of use thereof CASP1, IRAK1, STS F10 2337/4885HCAR3 3590/4885HPGD 3637/4885

“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.