SCHEMBL14494458

SCHEMBL14494458

CC1C2CC(C1C(=O)Oc1ccccc1)C1C3C=CC(C3)C21

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.41
▸ SLC6A3 Q01959 2/20 0.37
▸ GAA P10253 1/20 0.37
▸ SLC6A2 P23975 1/20 0.37
▸ SLC6A4 P31645 1/20 0.37

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
SCHEMBL1451490 0.79 ALDH1A1 (0.53) ALDH1A1GAA
SCHEMBL13346313 0.78 ALDH1A1 (0.34) ALDH1A1SLC6A3
SCHEMBL30663534 0.76 KMT2A (0.38) ALDH1A1GAA
SCHEMBL13346669 0.76 POLB (0.44) ALDH1A1
SCHEMBL5837417 0.75 ALDH1A1 (0.57) ALDH1A1GAA
SCHEMBL5837423 0.75 ALDH1A1 (0.57) ALDH1A1GAA
SCHEMBL14494433 0.74 SLC6A3 (0.38) ALDH1A1SLC6A3GAA
SCHEMBL14117797 0.73 FUCA1 (0.34) —
SCHEMBL12929282 0.71 ALDH1A1 (0.60) ALDH1A1GAA
SCHEMBL13346524 0.71 MEN1 (0.32) —

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-7230058-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-06-12 — — US disclosed
US-7230058-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-06-12 — — US disclosed
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