SCHEMBL8422904

SCHEMBL8422904

CC(F)(C(F)(F)CC1CO1)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.31
MAPK1 P28482 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
SCHEMBL8427026 1.00 ALDH1A1 (0.33) ALDH1A1TSHRMAPK1
SCHEMBL8423138 0.94 ALDH1A1 (0.34) ALDH1A1TSHRMAPK1
SCHEMBL2330815 0.90 ALDH1A1 (0.32) ALDH1A1TSHRMAPK1
SCHEMBL8427785 0.90 ALDH1A1 (0.32) ALDH1A1TSHRMAPK1
SCHEMBL7160296 0.90 ALDH1A1 (0.32) ALDH1A1TSHRMAPK1
SCHEMBL4625432 0.85 GBA1 (0.31)
SCHEMBL13354394 0.85 GBA1 (0.31)
SCHEMBL5945112 0.85 GBA1 (0.31)
SCHEMBL7940540 0.85 GBA1 (0.31)
SCHEMBL7941529 0.85 ALDH1A1 (0.37) ALDH1A1TSHRMAPK1

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-5710211-A REACTION OF POLYMER WITH COMPOUND HAVING A THIOL OR THIOESTER AND HYDROLYSIS TO FORM VINYL ALCOHOL KURARAY CO., LTD. (JP) 1998-01-20 US claimed
EP-0757060-B1 Process for producing vinyl alcohol polymer KURARAY CO (JP) 1999-10-20 EP disclosed
US-5710211-A REACTION OF POLYMER WITH COMPOUND HAVING A THIOL OR THIOESTER AND HYDROLYSIS TO FORM VINYL ALCOHOL KURARAY CO., LTD. (JP) 1998-01-20 US disclosed
EP-0757060-A2 Process for producing vinyl alcohol polymer KURARAY CO., LTD. (JP) 1997-02-05 EP disclosed