SCHEMBL14192801

SCHEMBL14192801

CC1CCC(C(C)(C)c2ccc(O)cc2)CC1c1ccc(OC=O)cc1

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.38
▸ KDM1A O60341 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
SCHEMBL1005966 0.87 ACHE (0.47) ACHEKDM1A
SCHEMBL4557279 0.80 ACHE (0.44) ACHEKDM1A
SCHEMBL14175570 0.75 MAPT (0.39) KDM1A
SCHEMBL9006050 0.71 ACHE (0.42) ACHEKDM1A
SCHEMBL13712969 0.70 ESR1 (0.59) —
SCHEMBL304805 0.70 ESR1 (0.59) —
SCHEMBL21538673 0.68 ESR1 (0.42) —
SCHEMBL27991644 0.68 ACHE (0.49) ACHEKDM1A
SCHEMBL14204947 0.67 — —
SCHEMBL15417635 0.66 ESR2 (0.53) —

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-20080146759-A1 Sulfur-Containing Compound, Method for Producing Same, Sulfur-Containing Polymer, and Optical Material IDEMITSU KOSAN CO., LTD (JP) 2008-06-19 — — US disclosed
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