SCHEMBL11234898

SCHEMBL11234898

FC(F)(F)c1ccc(CC(=S)Cl)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.47
PHGDH O43175 1/20 0.40
IDO1 P14902 2/20 0.39
NOTUM Q6P988 3/20 0.38
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
RXRG P48443 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.36
LMNA P02545 1/20 0.36
KIF11 P52732 1/20 0.36
CA2 P00918 1/20 0.35
OPRK1 P41145 1/20 0.35
KMO O15229 2/20 0.35
KCNH2 Q12809 1/20 0.34
PYCR1 P32322 1/20 0.33
GPR84 Q9NQS5 1/20 0.33
CCR2 P41597 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
SCHEMBL16237967 0.83 DAO (0.47) DAOIDO1NOTUMRXRARXRB
SCHEMBL1403550 0.79 RXRA (0.59) DAORXRARXRBRXRGMRGPRX4
SCHEMBL29989384 0.79 RXRA (0.59) DAORXRARXRBRXRGMRGPRX4
SCHEMBL2152251 0.78 KIF11 (0.51) DAOPHGDHIDO1NOTUMRXRA
SCHEMBL29844250 0.78 KIF11 (0.51) DAOPHGDHIDO1NOTUMRXRA
SCHEMBL5439219 0.77 IDO1 (0.50) IDO1CA2
SCHEMBL25802978 0.77 DAO (0.42) DAOPHGDHIDO1NOTUMRXRA
SCHEMBL29844336 0.77 DAO (0.42) DAOPHGDHIDO1NOTUMRXRA
SCHEMBL4656217 0.76 DAO (0.49) DAOPHGDHIDO1NOTUMRXRA
SCHEMBL24400227 0.74 DAO (0.48) DAOPHGDHIDO1NOTUMRXRA

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-4358606-A Esters of phenalkyloxycarbonylamino acids ZOECON CORPORATION (US) 1982-11-09 US disclosed