SCHEMBL6833729

SCHEMBL6833729

N#Cc1ccc(NC(=O)c2cc(-c3ccc4c(c3)OCO4)on2)c(C(=O)O)c1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.61
RAB9A P51151 7/20 0.61
MEN1 O00255 4/20 0.61
KMT2A Q03164 4/20 0.61
RXFP1 Q9HBX9 4/20 0.61
POLB P06746 2/20 0.61
MAPT P10636 5/20 0.58
THRB P10828 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
TP53 P04637 1/20 0.57
KLF5 Q13887 1/20 0.56
CHEK1 O14757 1/20 0.55
KLK7 P49862 1/20 0.54

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
SCHEMBL6830367 0.85 NPC1 (0.74) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL6813729 0.84 TDP1 (0.55) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL6834460 0.83 POLB (0.44) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL6821776 0.80 NPC1 (0.51) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL6818740 0.80 RXFP1 (0.71) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL6351992 0.80 NPC1 (0.61) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL6818931 0.78 KMT2A (0.60) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL6833885 0.78 TDP1 (0.49) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL6833848 0.76 KMT2A (0.56) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL6833933 0.76 NPC1 (0.54) NPC1RAB9AMEN1KMT2AMAPT

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-20040110802-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-06-10 US disclosed
WO-2004018428-A1 ANTIBACTERIAL BENZOIC ACID DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2004-03-04 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-20040110802-A1 Antibacterial benzoic acid derivatives GABRD, GABBR1, GABRA1 NPC1 3778/4885RAB9A 4337/4885MEN1 4132/4885

“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.