SCHEMBL6337169

SCHEMBL6337169

CCc1nc(-c2ccccn2)cn1-c1ccc(CCNC(=O)Oc2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
TAAR1 Q96RJ0 2/20 0.45
GAA P10253 2/20 0.45
F2 P00734 1/20 0.38
F12 P00748 1/20 0.38
MAPT P10636 3/20 0.38
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PKM P14618 1/20 0.37
TP53 P04637 1/20 0.37
ATM Q13315 1/20 0.37
PTPN1 P18031 1/20 0.36

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
SCHEMBL6177232 0.89 TAAR1 (0.48) NPC1RAB9ATAAR1GAAMAPT
SCHEMBL6336505 0.87 NAMPT (0.43) ALDH1A1L3MBTL1ATM
SCHEMBL6327138 0.86 TAAR1 (0.42) NPC1RAB9ATAAR1GAAMAPT
SCHEMBL6339222 0.84 RAB9A (0.44) NPC1RAB9ATAAR1GAAMAPT
SCHEMBL6328159 0.82 MGLL (0.46) NPC1RAB9ATAAR1GAAMAPT
SCHEMBL6176742 0.82 TAAR1 (0.47) NPC1RAB9ATAAR1GAAMAPT
SCHEMBL6177236 0.77 CA2 (0.50) MAPTALDH1A1SMN1; SMN2
SCHEMBL6176352 0.76 ALDH1A1 (0.44) NPC1RAB9AGAAMAPTALDH1A1
SCHEMBL6334832 0.72 TAAR1 (0.45) NPC1RAB9ATAAR1GAAALDH1A1
SCHEMBL6174762 0.72 TAAR1 (0.45) NPC1RAB9ATAAR1GAATP53

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-6956050-B2 Imidazole compounds as anti-inflammatory and analgesic agents PFIZER, INC. (US) 2005-10-18 US disclosed
US-20030220372-A1 Imidazole compounds as anti-inflammatory and analgesic agents HIRANO MISATO (JP) 2003-11-27 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-20030220372-A1 Imidazole compounds as anti-inflammatory and analgesic agents PTGS1, PTGS2, PTGES NPC1 959/4885RAB9A 1568/4885TAAR1 2861/4885

“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.