SCHEMBL6711906

SCHEMBL6711906

O=C(Nc1cccc2cc(C(=O)Nc3ccc(Cl)cc3-c3nnn[nH]3)[nH]c12)c1cc2ccccc2[nH]1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NHERF1 O14745 3/20 0.46
EGFR P00533 2/20 0.42
PIK3CA P42336 2/20 0.42
MGAM O43451 1/20 0.42
GAA P10253 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
NPC1 O15118 1/20 0.42
LMNA P02545 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
STK33 Q9BYT3 2/20 0.41
PYGL P06737 1/20 0.41
PLCG2 P16885 1/20 0.41
CCKAR P32238 1/20 0.41
HDAC2 Q92769 1/20 0.40
F10 P00742 1/20 0.40
IDO1 P14902 1/20 0.39

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
SCHEMBL6711642 0.93 NHERF1 (0.49) NHERF1EGFRPIK3CAMGAMGAA
SCHEMBL6713754 0.92 SERPINE1 (0.43) NHERF1GAASTK33PLCG2
SCHEMBL6710112 0.90 MAP3K5 (0.45) NHERF1NPC1LMNARAB9ASTK33
SCHEMBL6710125 0.89 SERPINE1 (0.48) NHERF1NPC1LMNARAB9ASMN1; SMN2
SCHEMBL6711486 0.89 NPC1 (0.42) EGFRPIK3CANPC1LMNARAB9A
SCHEMBL6710216 0.89 KCNMA1 (0.46) NHERF1GAANPC1LMNARAB9A
SCHEMBL6708019 0.88 GPR35 (0.44) NHERF1GAASTK33PLCG2
SCHEMBL6711816 0.88 PLCG2 (0.44) NHERF1LMNASTK33PYGLPLCG2
SCHEMBL6710087 0.88 PLCG2 (0.39) NHERF1NPC1LMNARAB9ASMN1; SMN2
SCHEMBL6709211 0.88 PLCG2 (0.39) NHERF1LMNASTK33PYGLPLCG2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040142981-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-07-22 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-20040142981-A1 Antibacterial benzoic acid derivatives GABRD, PHB1, GABBR1 NHERF1 1641/4885EGFR 2231/4885PIK3CA 2906/4885

“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.