SCHEMBL27440995

SCHEMBL27440995

C=C(C)/C(C#N)=C/c1cn(Cc2ccc(Cl)c(C(C)(F)F)c2)c2ncccc12

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 6/20 0.51
▸ SNCA P37840 6/20 0.51
▸ ENPP2 Q13822 2/20 0.42
▸ MAPT P10636 4/20 0.36
▸ THRB P10828 2/20 0.36
▸ CNR1 P21554 2/20 0.35
▸ CNR2 P34972 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ PDE4A P27815 1/20 0.33
▸ PDE4B Q07343 1/20 0.33
▸ PDE4C Q08493 1/20 0.33
▸ PDE4D Q08499 1/20 0.33

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
SCHEMBL27440741 0.86 APP (0.52) APPSNCAENPP2MAPTTHRB
SCHEMBL31050165 0.83 APP (0.55) APPSNCAENPP2MAPTTHRB
SCHEMBL27440440 0.83 APP (0.55) APPSNCAENPP2MAPTTHRB
SCHEMBL25773497 0.83 SNCA (0.53) APPSNCAENPP2MAPTTHRB
SCHEMBL27440427 0.83 APP (0.46) APPSNCAENPP2CNR1CNR2
SCHEMBL24164335 0.82 SNCA (0.57) APPSNCAENPP2MAPTTHRB
SCHEMBL27440771 0.79 SNCA (0.54) APPSNCAENPP2MAPTTHRB
SCHEMBL24163776 0.75 APP (0.60) APPSNCAENPP2MAPTTHRB
SCHEMBL27440660 0.74 APP (0.59) APPSNCAENPP2MAPTTHRB
SCHEMBL31050168 0.74 APP (0.52) APPSNCAENPP2MAPTTHRB

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
WO-2024145369-A1 COMPOUNDS FOR TREATMENT OF HAIR LOSS PELAGE PHARMACEUTICALS, INC. (US) 2024-07-04 — — WO disclosed
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