SCHEMBL8330971

SCHEMBL8330971

CSC1(SC)CCOc2ccc(C3[CH]CCC3)cc21

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAP3K14 Q99558 1/20 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
SCHEMBL8331567 0.96 MAP3K14 (0.30) MAP3K14
SCHEMBL8333554 0.83 RARA (0.41) MAP3K14
SCHEMBL8332049 0.81 RARA (0.41) MAP3K14
SCHEMBL7571998 0.74
SCHEMBL4373634 0.71 LMNA (0.42)
SCHEMBL9054289 0.71 MAPT (0.41)
SCHEMBL9053853 0.70 ALDH1A1 (0.42)
Hydrochloric Acid SCHEMBL21750681 0.70 MAPT (0.44)
SCHEMBL8331366 0.68 RXRA (0.40)
SCHEMBL8197285 0.68 AKR1B1 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5917082-A 2,4-pentadienoic acid derivatives having retinoid-like biological activity ALLERGAN SALES, INC. (US) 1999-06-29 US disclosed
US-5817836-A 2,4-pentadienoic acid derivatives having retinoid-like biological activity ALLERGAN (US) 1998-10-06 US disclosed
US-5780647-A 2,4-Pentadienoic acid derivatives having retinoid-like biological activity ALLERGAN (US) 1998-07-14 US disclosed
US-5675033-A FOR TREATMENT OF SKIN DISORDERS ALLERGAN (US) 1997-10-07 US disclosed