SCHEMBL26304397

SCHEMBL26304397

CCCC(CCC)c1cccc(F)n1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.35
KCNB1 Q14721 1/20 0.32
MAPT P10636 1/20 0.31
CYP2D6 P10635 1/20 0.30
KCNH2 Q12809 1/20 0.30
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30

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
SCHEMBL18596899 0.86 KCNH2 (0.41) HRH1KCNH2
SCHEMBL19003563 0.78 HTT (0.42)
SCHEMBL23717412 0.77 ADRB1 (0.50)
SCHEMBL25440572 0.75 KCNH2 (0.37) HRH1KCNB1KCNH2
SCHEMBL12891857 0.74 HRH1 (0.38) HRH1KCNB1MAPT
SCHEMBL8297992 0.74 HRH1 (0.38) HRH1KCNB1MAPT
SCHEMBL12891853 0.74 HRH1 (0.38) HRH1KCNB1MAPT
SCHEMBL21078223 0.74 NCF1 (0.35) KCNH2
SCHEMBL2759108 0.73 HRH1 (0.38) HRH1KCNB1MAPT
SCHEMBL26217680 0.72 SLC6A4 (0.36) MAPTCYP2D6KCNH2

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-20230242505-A1 PROCESS, COMPOSITIONS, AND CRYSTALLINE FORMS OF SUBSTITUTED PYRIDINONE-PYRIDINYL COMPOUNDS ACLARIS THERAPEUTICS, INC. 2023-08-03 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-20230242505-A1 PROCESS, COMPOSITIONS, AND CRYSTALLINE FORMS OF SUBSTITUTED PYRIDINONE-PYRIDINYL COMPOUNDS MAPK6, MAPK1, MAPK8 HRH1 1269/4885KCNB1 2333/4885MAPT 828/4885

“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.