SCHEMBL3941964

SCHEMBL3941964

NC(=O)c1ccc2cc3n(c2c1)CC(C(=O)O)=Cc1ccccc1-3

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RPS6KA3 P51812 4/20 0.43
PLA2G10 O15496 1/20 0.36
RPS6KA2 Q15349 4/20 0.35
PLAU P00749 1/20 0.34
FGFR1 P11362 1/20 0.34
CHEK2 O96017 3/20 0.33
ROCK2 O75116 1/20 0.33
PIM1 P11309 1/20 0.33
PIM3 Q86V86 1/20 0.33
BAZ2B Q9UIF8 1/20 0.33
BAZ2A Q9UIF9 1/20 0.33
PDK2 Q15119 1/20 0.33
CTRB1 P17538 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
SCN2A Q99250 1/20 0.32
ACSS2 Q9NR19 1/20 0.32

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
SCHEMBL3938873 0.93 RPS6KA3 (0.45) RPS6KA3PLA2G10RPS6KA2PLAUFGFR1
SCHEMBL50870 0.92 POLB (0.39) RPS6KA3RPS6KA2FGFR1CA12CA1
SCHEMBL51354 0.87 DAO (0.38) CA12CA9
SCHEMBL3946964 0.86 RPS6KA2 (0.41) RPS6KA3RPS6KA2PDK2ACSS2
SCHEMBL50820 0.82 RPS6KA3 (0.49) RPS6KA3PLA2G10RPS6KA2PLAUFGFR1
SCHEMBL5304198 0.78 HPGD (0.45)
SCHEMBL271134 0.78 RPS6KA3 (0.46) RPS6KA3PLA2G10RPS6KA2PLAUFGFR1
SCHEMBL4831504 0.76 RPS6KA3 (0.40) RPS6KA3RPS6KA2
SCHEMBL253105 0.74 HTR1A (0.34)
SCHEMBL4830051 0.74 SMN1; SMN2 (0.37) RPS6KA3RPS6KA2FGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7473688-B2 Indolobenzazepine HCV NS5B inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2009-01-06 US disclosed
US-20070078122-A1 Indolobenzazepine HCV NS5B inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-04-05 US disclosed
WO-2007033175-A1 INDOLOBENZAZEPINE HCV NS5B INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-03-22 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-20070078122-A1 Indolobenzazepine HCV NS5B inhibitors HTR3C, IDO1, HTR3B RPS6KA3 2580/4885PLA2G10 3811/4885RPS6KA2 3301/4885

“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.