SCHEMBL11819472

SCHEMBL11819472

O=C(O)c1cc(C(F)(F)F)ccc1SCc1cccc(I)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FKBP1A P62942 1/20 0.47
▸ GFER P55789 1/20 0.45
▸ KCNQ3 O43525 1/20 0.43
▸ KCNQ2 O43526 1/20 0.43
▸ EPHX1 P07099 3/20 0.41
▸ PPARG P37231 3/20 0.41
▸ PPARA Q07869 3/20 0.41
▸ PTPRG P23470 2/20 0.41
▸ NPSR1 Q6W5P4 3/20 0.41
▸ L3MBTL1 Q9Y468 3/20 0.41
▸ MAPT P10636 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ AR P10275 1/20 0.40
▸ MRGPRX4 Q96LA9 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ ALPG P10696 1/20 0.40

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
SCHEMBL11823732 0.90 GFER (0.54) FKBP1AGFEREPHX1NPSR1L3MBTL1
SCHEMBL10746094 0.87 FKBP1A (0.53) FKBP1AGFERKCNQ3KCNQ2PPARG
SCHEMBL11820125 0.86 FKBP1A (0.52) FKBP1AGFERKCNQ3KCNQ2PPARG
SCHEMBL11821844 0.86 FKBP1A (0.52) FKBP1AGFERKCNQ3KCNQ2PPARG
Ammonia Solution, Strong SCHEMBL11820558 0.86 FKBP1A (0.52) FKBP1AGFERKCNQ3KCNQ2EPHX1
SCHEMBL11821280 0.86 FKBP1A (0.52) FKBP1AGFERKCNQ3KCNQ2PPARG
SCHEMBL11819040 0.86 FKBP1A (0.52) FKBP1AGFERKCNQ3KCNQ2PPARG
SCHEMBL11825095 0.86 FKBP1A (0.52) FKBP1AGFERKCNQ3KCNQ2PPARG
SCHEMBL10741558 0.85 FKBP1A (0.47) FKBP1AGFERKCNQ3KCNQ2EPHX1
SCHEMBL11820534 0.80 EPHX1 (0.51) GFEREPHX1NPSR1L3MBTL1MAPT

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-3954994-A Intermediates for preparing hipolipemic agents and method of lowering the blood lipid level in mammals with said agents PFIZER INC. (US) 1976-05-04 — — US disclosed
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