SCHEMBL23960274

SCHEMBL23960274

CC1CCC(C2CCC(C#Cc3ccc(SC#N)cc3)CC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
FFAR1 O14842 3/20 0.35
CA2 P00918 1/20 0.31
CA5A P35218 1/20 0.31
FFAR4 Q5NUL3 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
SCHEMBL9498830 0.83 FFAR1 (0.39) ALDH1A1FFAR1FFAR4
SCHEMBL9498836 0.83 FFAR1 (0.39) ALDH1A1FFAR1FFAR4
SCHEMBL9855720 0.83 FFAR1 (0.39) ALDH1A1FFAR1FFAR4
SCHEMBL10513499 0.75 FFAR1 (0.36) ALDH1A1FFAR1FFAR4
SCHEMBL9497535 0.74 HRH3 (0.45) FFAR1
SCHEMBL9497527 0.74 HRH3 (0.45) FFAR1
SCHEMBL24718506 0.74 FFAR1 (0.33) ALDH1A1MAPTFFAR1
SCHEMBL9498537 0.74 MEN1 (0.36) FFAR1FFAR4
SCHEMBL9498524 0.74 MEN1 (0.36) FFAR1FFAR4
SCHEMBL20749394 0.72 ESR2 (0.44) ALDH1A1MAPTFFAR1CA2CA5A

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-11345855-B2 Liquid crystal composition and display device BOE TECHNOLOGY GROUP CO., LTD. (CN) 2022-05-31 US disclosed
US-20210332296-A1 LIQUID CRYSTAL COMPOSITION AND DISPLAY DEVICE Beijing Boe Technology Development Co., Ltd. (CN) 2021-10-28 US disclosed