SCHEMBL9789331

SCHEMBL9789331

C=CCCCCCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
ABCC4 O15439 1/20 0.32
MAPT P10636 1/20 0.32
TRPA1 O75762 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
SCHEMBL30120014 1.00 TSHR (0.37) TSHRALDH1A1LMNAABCC4MAPT
SCHEMBL10710735 1.00 TSHR (0.37) TSHRALDH1A1LMNAABCC4MAPT
SCHEMBL6664827 1.00 TSHR (0.37) TSHRALDH1A1LMNAABCC4MAPT
SCHEMBL10712198 1.00 TSHR (0.37) TSHRALDH1A1LMNAABCC4MAPT
SCHEMBL10712083 1.00 TSHR (0.37) TSHRALDH1A1LMNAABCC4MAPT
SCHEMBL10708125 1.00 TSHR (0.37) TSHRALDH1A1LMNAABCC4MAPT
SCHEMBL10711996 1.00 TSHR (0.37) TSHRALDH1A1LMNAABCC4MAPT
SCHEMBL10713524 0.98 TSHR (0.38) TSHRALDH1A1LMNAABCC4MAPT
SCHEMBL9789262 0.98 TSHR (0.38) TSHRALDH1A1LMNAABCC4MAPT
SCHEMBL10708830 0.98 TSHR (0.38) TSHRALDH1A1LMNAABCC4MAPT

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-5011963-A Terminal perfluoroalkylsilane compounds MATSUSHITA ELECTRIC IND., CO., LTD. (JP) 1991-04-30 US disclosed