SCHEMBL27223370

SCHEMBL27223370

Fc1ccc2nc(Nc3ccc(F)c(F)c3)nc(NC3CCCCC3)c2c1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MERTK Q12866 6/20 0.64
NPY5R Q15761 1/20 0.47
HTR2A P28223 2/20 0.45
HTR2C P28335 2/20 0.45
CCR4 P51679 1/20 0.44
PAK4 O96013 1/20 0.44
CAMK2D Q13557 1/20 0.43
TOP2A P11388 1/20 0.43
JAK2 O60674 1/20 0.43
SOS1 Q07889 2/20 0.42

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
SCHEMBL30896236 0.90 MERTK (0.56) MERTKNPY5RCCR4PAK4CAMK2D
SCHEMBL30896205 0.90 MERTK (0.56) MERTKNPY5RCCR4CAMK2DTOP2A
SCHEMBL27223397 0.90 MERTK (0.56) MERTKNPY5RCCR4PAK4CAMK2D
SCHEMBL27224039 0.90 MERTK (0.56) MERTKNPY5RCCR4CAMK2DTOP2A
SCHEMBL27223952 0.89 MERTK (0.55) MERTKNPY5RCCR4CAMK2DTOP2A
SCHEMBL27223955 0.88 MERTK (0.54) MERTKNPY5RCCR4CAMK2D
SCHEMBL24649804 0.88 MERTK (0.75) MERTKNPY5RCAMK2DSOS1
SCHEMBL30896206 0.88 MERTK (0.75) MERTKNPY5RCAMK2DSOS1
SCHEMBL30896197 0.80 PAK4 (0.56) MERTKPAK4CAMK2DSOS1
SCHEMBL27223450 0.80 PAK4 (0.56) MERTKPAK4CAMK2DSOS1

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-20240166626-A1 Compounds and Methods for Preventing, Treating, or Ameliorating Airway Disease UNIV JEFFERSON (US) 2024-05-23 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-20240166626-A1 Compounds and Methods for Preventing, Treating, or Ameliorating Airway Disease ADRB2, ADRB1, ADRB3 MERTK 3423/4885NPY5R 2011/4885HTR2A 387/4885

“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.