SCHEMBL20118384

SCHEMBL20118384

N=C(NC(=O)Oc1ccccc1)c1ccc(N)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.44
MAPT P10636 4/20 0.42
GAA P10253 3/20 0.42
KDM4E B2RXH2 2/20 0.42
GLA P06280 2/20 0.42
THRB P10828 2/20 0.42
BLM P54132 1/20 0.42
CASP6 P55212 1/20 0.42
GFER P55789 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
NFKB1 P19838 2/20 0.41
NFKB2 Q00653 2/20 0.41
RELA Q04206 2/20 0.41
LMNA P02545 2/20 0.41
TP53 P04637 2/20 0.41
CYP3A4 P08684 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
CHRM1 P11229 1/20 0.41
TBXA2R P21731 1/20 0.41
SLC6A2 P23975 1/20 0.41

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
SCHEMBL7988545 0.81 SLC1A3 (0.41) SLC1A3MAPTGAAKDM4EGLA
SCHEMBL7062605 0.80 PLAU (0.43) MAPTGAAKDM4EGLATDP1
SCHEMBL548327 0.80 NQO2 (0.49) TDP1ALDH1A1HPGDPRSS1TMPRSS15
SCHEMBL6655085 0.78 PLAU (0.49) TDP1LMNASLC6A2SLC6A3SMN1; SMN2
SCHEMBL7307963 0.77 KMT2A (0.50) MAPTKDM4ETDP1LMNACYP3A4
Hydrochloric Acid SCHEMBL15251731 0.77 PLAU (0.48) TDP1LMNASLC6A2SLC6A3SMN1; SMN2
SCHEMBL13882702 0.76 SLC1A3 (0.47) SLC1A3MAPTGAAKDM4ETHRB
SCHEMBL3862551 0.76 MASP2 (0.46) MAPTKDM4ETDP1LMNACYP3A4
SCHEMBL2551644 0.75 ALDH1A1 (0.55) SLC1A3MAPTGAAKDM4ETHRB
SCHEMBL8301048 0.75 MAOA (0.45) MAPTGAATDP1CYP3A4SMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11618731-B2 Prodrugs of kallikrein inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2023-04-04 US disclosed
EP-3532057-B1 PRODRUGS OF KALLIKREIN INHIBITORS BIOCRYST PHARM INC (US) 2022-12-21 EP disclosed
EP-3532057-B1 PRODRUGS OF KALLIKREIN INHIBITORS BIOCRYST PHARM INC (US) 2022-12-21 EP disclosed
US-20210198204-A1 PRODRUGS OF KALLIKREIN INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2021-07-01 US disclosed
US-10759759-B2 Prodrugs of kallikrein inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2020-09-01 US disclosed
WO-2018081513-A1 PRODRUGS OF KALLIKREIN INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2018-05-03 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 (3 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-20210198204-A1 PRODRUGS OF KALLIKREIN INHIBITORS KLKB1, SERPINB1, KLK1 SLC1A3 2036/4885MAPT 3099/4885GAA 366/4885
US-11618731-B2 Prodrugs of kallikrein inhibitors KLKB1, SERPINB1, KLK1 SLC1A3 2036/4885MAPT 3099/4885GAA 366/4885
US-10759759-B2 Prodrugs of kallikrein inhibitors KLKB1, SERPINB1, KLK1 SLC1A3 2036/4885MAPT 3099/4885GAA 366/4885

“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.