SCHEMBL8854573

SCHEMBL8854573

CO[PH](=O)OS(=O)(=O)c1c(C)cccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC40A1 Q9NP59 1/20 0.37
CCR1 P32246 5/20 0.34
NR3C1 P04150 1/20 0.33
CCR4 P51679 1/20 0.32
ATM Q13315 1/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 2/20 0.31
MAPK1 P28482 2/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
HTT P42858 1/20 0.31
TP53 P04637 1/20 0.31
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
AKR1C3 P42330 1/20 0.31
FFAR4 Q5NUL3 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
SCHEMBL8854426 0.90 ATM (0.34) CCR4ATMALDH1A1KMT2AMEN1
SCHEMBL8854556 0.86 SLC40A1 (0.35) SLC40A1CCR1NR3C1
SCHEMBL8854468 0.80 CYP1A2 (0.33) ALDH1A1LMNATSHR
SCHEMBL8854526 0.79 KMT2A (0.35) CCR4TSHRKMT2AMEN1
SCHEMBL9715139 0.77 SLC40A1 (0.35) SLC40A1CCR1NR3C1ALDH1A1LMNA
SCHEMBL8854640 0.76 SLC40A1 (0.36) SLC40A1CCR1NR3C1ATMALDH1A1
SCHEMBL27387720 0.76 SLC40A1 (0.40) SLC40A1CCR1NR3C1ATMALDH1A1
SCHEMBL8854522 0.76 LMNA (0.31) LMNA
SCHEMBL8854505 0.76 HSD11B1 (0.32)
SCHEMBL8854417 0.75 TUBB4A (0.32) CCR4ATMALDH1A1KMT2AMEN1

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-5693590-A PLANT GROWTH REGULATOR ROHM AND HAAS COMPANY (US) 1997-12-02 US claimed