SCHEMBL7990296

SCHEMBL7990296

OC(CCl)C(O)C(O)C(Cl)CCl

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
TP53 P04637 1/20 0.36
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL28705920 0.79 TSHR (0.38) TSHRTDP1TP53ALDH1A1
SCHEMBL8765540 0.78
SCHEMBL7344387 0.77 TSHR (0.44) TSHRTDP1TP53ALDH1A1LMNA
SCHEMBL11079234 0.73 LMNA (0.69) TSHRTDP1TP53ALDH1A1LMNA
SCHEMBL11075814 0.73 LMNA (0.69) TSHRTDP1TP53ALDH1A1LMNA
SCHEMBL5499741 0.73 TSHR (0.38) TSHRTDP1TP53ALDH1A1
SCHEMBL11451770 0.73 LMNA (0.69) TSHRTDP1TP53ALDH1A1LMNA
SCHEMBL8215023 0.73 LMNA (0.69) TSHRTDP1TP53ALDH1A1LMNA
SCHEMBL11071241 0.73 LMNA (0.69) TSHRTDP1TP53ALDH1A1LMNA
SCHEMBL3801509 0.73 LMNA (0.69) TSHRTDP1TP53ALDH1A1LMNA

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-6288248-B1 REACTION OF ALLYL CHLORIDE AND PEROXIDE IN WATER AND METHANOL Solvay (Société Anonyme) (BE) 2001-09-11 US claimed
US-4937192-A ISOLATION FROM FERMENTATION CULTURE; EFFICIENCY CETUS CORPORATION (US) 1990-06-26 US disclosed
US-4707447-A OXIDATION, HALOGENATION CETUS CORPORATION (US) 1987-11-17 US disclosed