SCHEMBL6834022

SCHEMBL6834022

N#Cc1ccc(NC(=O)c2cc3ccccc3[nH]2)c(C(=O)O)c1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.55
LMNA P02545 1/20 0.55
RAB9A P51151 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
CCKAR P32238 5/20 0.55
NHERF1 O14745 1/20 0.54
CCKBR P32239 4/20 0.51
PIN1 Q13526 1/20 0.51
EGFR P00533 1/20 0.49
PIK3CA P42336 1/20 0.49
BCAT1 P54687 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
SCHEMBL6835708 0.93 CCKAR (0.51) NPC1LMNARAB9ASMN1; SMN2CCKAR
SCHEMBL6834101 0.85 NHERF1 (0.56) NHERF1
SCHEMBL6834154 0.84 KMT2A (0.49) NPC1RAB9ANHERF1
SCHEMBL6835826 0.83 KDM4E (0.61) NPC1RAB9ANHERF1
SCHEMBL6834270 0.83 FLT3 (0.50) NPC1RAB9ACCKARNHERF1CCKBR
SCHEMBL6833112 0.83 KDM4E (0.57) NPC1RAB9ANHERF1BCAT1
SCHEMBL13701154 0.82 NHERF1 (0.74) NPC1LMNARAB9ASMN1; SMN2CCKAR
SCHEMBL6818302 0.82 NSD2 (0.58) NPC1RAB9ANHERF1
SCHEMBL6833085 0.82 ALB (0.43) NHERF1
SCHEMBL6830559 0.82 NHERF1 (0.45) NHERF1

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 claimed
US-20040110802-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-06-10 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-20040110802-A1 Antibacterial benzoic acid derivatives GABRD, GABBR1, GABRA1 NPC1 3778/4885LMNA 3376/4885RAB9A 4337/4885

“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.