SCHEMBL30702007

SCHEMBL30702007

O=c1[nH]c2cc(-c3ccccc3Cl)sc2c(=O)n1-c1cnccc1N1CCNCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.40
PIM1 P11309 1/20 0.39
PIM2 Q9P1W9 1/20 0.39
MAPK14 Q16539 1/20 0.37
ADRB1 P08588 2/20 0.36
CHEK1 O14757 3/20 0.36
ERCC5 P28715 1/20 0.34
FEN1 P39748 1/20 0.34
PRKCI P41743 1/20 0.34
TOP1 P11387 1/20 0.33
TOP2A P11388 1/20 0.33
WEE1 P30291 1/20 0.33
PRKCQ Q04759 1/20 0.33
CYP1A2 P05177 2/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2C19 P33261 2/20 0.32
LMNA P02545 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
MEN1 O00255 1/20 0.32
CYP2D6 P10635 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
SCHEMBL27191946 1.00 HTR7 (0.40) HTR7PIM1PIM2MAPK14ADRB1
SCHEMBL27378922 0.90 PIK3C3 (0.40) MAPK14ERCC5FEN1LMNAMEN1
SCHEMBL30702065 0.86 ATR (0.35) ERCC5FEN1
SCHEMBL27192134 0.86 ATR (0.35) ERCC5FEN1
SCHEMBL27379541 0.83 ERCC5 (0.40) MAPK14ERCC5FEN1CYP3A4CYP2C19
SCHEMBL30701959 0.83 CYP3A4 (0.43) HTR7PIM1PIM2MAPK14ADRB1
SCHEMBL27191803 0.83 CYP3A4 (0.43) HTR7PIM1PIM2MAPK14ADRB1
SCHEMBL27192214 0.83 CYP17A1 (0.39) ERCC5FEN1
SCHEMBL30702053 0.83 CYP17A1 (0.39) ERCC5FEN1
SCHEMBL29326559 0.79 PIK3C3 (0.44) ERCC5FEN1LMNAMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4565574-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. (US) 2025-06-11 EP disclosed
CN-119731159-A SARS-CoV2 main proteinase inhibitor 吉利德科学公司 2025-03-28 CN disclosed
US-20240239807-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. 2024-07-18 US disclosed
WO-2024031089-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. (US) 2024-02-08 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-20240239807-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE HTR7 3991/4885PIM1 378/4885PIM2 111/4885

“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.