SCHEMBL6470099

SCHEMBL6470099

CCCCOc1cccc(NC(=O)OC(C)(C)C)c1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 7/20 0.66
THRB P10828 1/20 0.64
NR1H4 Q96RI1 5/20 0.56
LMNA P02545 2/20 0.52
HPGD P15428 1/20 0.52
RAB9A P51151 1/20 0.52
MAPT P10636 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HTT P42858 2/20 0.49
ALDH1A1 P00352 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL595191 0.88 FAAH (0.51) FAAHTHRBNR1H4LMNARAB9A
SCHEMBL6470532 0.88 HTT (0.58) FAAHTHRBNR1H4LMNARAB9A
SCHEMBL7861824 0.87 FAAH (0.50) FAAHTHRBLMNARAB9AMAPT
SCHEMBL21768037 0.87 THRB (0.51) FAAHTHRBNR1H4LMNARAB9A
SCHEMBL6595861 0.86 FAAH (0.50) FAAHTHRBLMNAMAPTSMN1; SMN2
SCHEMBL12519749 0.86 FAAH (0.50) FAAHTHRBNR1H4RAB9AMAPT
SCHEMBL19363215 0.86 EPHX2 (0.51) FAAHTHRBLMNAHPGDRAB9A
SCHEMBL7076022 0.86 THRB (0.67) THRBNR1H4LMNAMAPTSMN1; SMN2
SCHEMBL12518630 0.85 FAAH (0.49) FAAHTHRBNR1H4MAPTMEN1
SCHEMBL31520993 0.85 ITK (0.50) FAAHTHRBHPGDMAPTSMN1; SMN2

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-20050124562-A1 Bis-quinazoline compounds for the treatment of bacterial infections REPLIDYNE, INC. 2005-06-09 US disclosed
WO-2005030131-A2 BIS-QUINAZOLINE COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS REPLIDYNE, INC (US) 2005-04-07 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-20050124562-A1 Bis-quinazoline compounds for the treatment of bacterial infections POLI, POLK, POLB FAAH 2417/4885THRB 3675/4885NR1H4 2127/4885

“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.