SCHEMBL11199740

SCHEMBL11199740

C#CCc1cc(C)c([CH2])c(C)c1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PYCR1 P32322 2/20 0.31

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
SCHEMBL28038072 0.74 PYCR1 (0.31) PYCR1
SCHEMBL11197732 0.74 PYCR1 (0.31) PYCR1
SCHEMBL11201018 0.74 SHBG (0.34)
SCHEMBL28273083 0.73 MAOA (0.31)
SCHEMBL10879909 0.70 PTGS2 (0.36)
SCHEMBL18346215 0.69 KDM4E (0.37)
SCHEMBL28037358 0.69 ACHE (0.42)
SCHEMBL2886778 0.68 ESR1 (0.61)
SCHEMBL20262942 0.67 HTT (0.41)
SCHEMBL10659903 0.65 FFAR4 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4411912-A Insecticidal isovaleric acid esters ZOECON CORPORATION (US) 1983-10-25 US disclosed
US-4243819-A Substituted amino acids ZOECON CORPORATION (US) 1981-01-06 US disclosed