SCHEMBL5407912

SCHEMBL5407912

C=CCCCCC(C)S(=O)(=O)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
ALDH1A1 P00352 3/20 0.33
USP2 O75604 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 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
SCHEMBL17120354 0.77 MAPT (0.32) TSHRALDH1A1USP2CYP3A4MAPT
SCHEMBL23500269 0.75 LMNA (0.37) ALDH1A1LMNA
SCHEMBL23500272 0.75 LMNA (0.37) ALDH1A1LMNA
SCHEMBL31715459 0.74 ALDH1A1 (0.41) TSHRALDH1A1USP2CYP3A4MAPT
Fluoride SCHEMBL27497656 0.73 ALDH1A1 (0.40) TSHRALDH1A1USP2CYP3A4MAPT
SCHEMBL5460556 0.72 ATR (0.30)
SCHEMBL8545920 0.71 ALDH1A1 (0.37) TSHRALDH1A1USP2CYP3A4MAPT
SCHEMBL17167129 0.70 TP53 (0.34)
SCHEMBL16159932 0.70 TP53 (0.34)
SCHEMBL3123538 0.69 TSHR (0.41) TSHRALDH1A1USP2CYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7294449-B1 Radiation patternable functional materials, methods of their use, and structures formed therefrom KOVIO, INC. (US) 2007-11-13 US disclosed