SCHEMBL8423671

SCHEMBL8423671

FC(C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)COCC1CO1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
MAPK1 P28482 1/20 0.43
ALDH1A1 P00352 3/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL8426911 0.92 TSHR (0.42) TSHRMAPK1ALDH1A1SMN1; SMN2
SCHEMBL709622 0.85 TSHR (0.47) TSHRMAPK1ALDH1A1SMN1; SMN2TDP1
SCHEMBL23964677 0.85 TSHR (0.47) TSHRMAPK1ALDH1A1SMN1; SMN2TDP1
SCHEMBL1071670 0.81 TSHR (0.53) TSHRMAPK1ALDH1A1SMN1; SMN2TDP1
SCHEMBL16517868 0.81 TSHR (0.57) TSHRMAPK1ALDH1A1SMN1; SMN2TDP1
SCHEMBL16808766 0.81 TSHR (0.57) TSHRMAPK1ALDH1A1SMN1; SMN2TDP1
SCHEMBL9513868 0.80 TSHR (0.52) TSHRMAPK1ALDH1A1SMN1; SMN2TDP1
SCHEMBL1412793 0.79 TSHR (0.55) TSHRMAPK1ALDH1A1SMN1; SMN2TDP1
SCHEMBL711178 0.79 TSHR (0.44) TSHRMAPK1ALDH1A1SMN1; SMN2TDP1
SCHEMBL711057 0.79 TSHR (0.44) TSHRMAPK1ALDH1A1SMN1; SMN2TDP1

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 3 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
EP-0757060-A2 Process for producing vinyl alcohol polymer KURARAY CO., LTD. (JP) 1997-02-05 EP disclosed