SCHEMBL6177331

SCHEMBL6177331

CC(C)c1nc(-c2ccccc2)cn1-c1ccc(CCN)cc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.39
NPC1 O15118 2/20 0.39
LMNA P02545 2/20 0.39
RAB9A P51151 2/20 0.39
MAPT P10636 1/20 0.39
CXCR3 P49682 10/20 0.38
HTR2A P28223 2/20 0.38
LOXL2 Q9Y4K0 2/20 0.38
TAAR1 Q96RJ0 2/20 0.38
CYP2A6 P11509 1/20 0.38
TLR8 Q9NR97 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
PTGS2 P35354 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
SCHEMBL6173956 0.87 CXCR3 (0.40) SMN1; SMN2NPC1LMNARAB9AMAPT
SCHEMBL6173740 0.87 NPC1 (0.39) SMN1; SMN2NPC1LMNARAB9AMAPT
SCHEMBL4453049 0.84 MAPT (0.40) SMN1; SMN2NPC1LMNARAB9AMAPT
SCHEMBL6177327 0.81 SPNS2 (0.43) SMN1; SMN2NPC1LMNARAB9AMAPT
SCHEMBL6174933 0.77 TAAR1 (0.43) SMN1; SMN2NPC1LMNARAB9AMAPT
SCHEMBL6173167 0.70 LMNA (0.39) SMN1; SMN2NPC1LMNARAB9AMAPT
SCHEMBL28111728 0.70 PTGS1 (0.54) SMN1; SMN2NPC1LMNARAB9AMAPT
SCHEMBL6178920 0.69 GPR119 (0.41) SMN1; SMN2NPC1LMNARAB9AMAPT
SCHEMBL10168099 0.68 PDE10A (0.42) SMN1; SMN2NPC1RAB9AMAPTTLR8
SCHEMBL6175631 0.68 PTGS1 (0.55) SMN1; SMN2NPC1LMNARAB9AMAPT

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 4 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
EP-1494667-A1 IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS Pfizer Japan Inc. (JP) 2005-01-12 EP disclosed
US-20030220372-A1 Imidazole compounds as anti-inflammatory and analgesic agents HIRANO MISATO (JP) 2003-11-27 US disclosed
WO-2003086390-A1 IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER JAPAN INC. (JP) 2003-10-23 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-20030220372-A1 Imidazole compounds as anti-inflammatory and analgesic agents PTGS1, PTGS2, PTGES SMN1; SMN2 4565/4885NPC1 959/4885LMNA 4151/4885

“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.