SCHEMBL25097014

SCHEMBL25097014

CCOc1cccc(F)n1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.49
BTK Q06187 1/20 0.45
HTR7 P34969 1/20 0.40
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 1/20 0.38
RAB9A P51151 1/20 0.38
MAPT P10636 1/20 0.37
DRD4 P21917 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36

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
SCHEMBL2525163 0.84 MAPK8 (0.56) MAPK8BTKHTR7NPC1ALDH1A1
SCHEMBL7565905 0.82 NCF1 (0.42) MAPK8HTR7
SCHEMBL8504109 0.80 MCHR1 (0.43) HTR7
SCHEMBL7161 0.79 HTR7 (0.61) MAPK8BTKHTR7NPC1ALDH1A1
SCHEMBL27564139 0.79 DRD4 (0.36) HTR7MAPTDRD4
SCHEMBL23462621 0.79 DRD4 (0.36) HTR7MAPTDRD4
SCHEMBL113568 0.79 HTR7 (0.44) HTR7MAPTDRD4
SCHEMBL2370822 0.79 NUDT1 (0.50) HTR7MAPTDRD4
SCHEMBL16511922 0.78 BTK (0.65) MAPK8BTKHTR7NPC1ALDH1A1
SCHEMBL7564408 0.78 HTR7 (0.41) HTR7FFAR4

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-20230071620-A1 PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. 2023-03-09 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-20230071620-A1 PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, TFPI, CFH MAPK8 568/4885BTK 871/4885HTR7 2401/4885

“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.