SCHEMBL31474565

SCHEMBL31474565

O=C(O)c1ccc(F)cn1.[Ir]

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 13/20 0.57
P4HA1 P13674 1/20 0.57
MIF P14174 1/20 0.57
KDM4E B2RXH2 5/20 0.55
ALDH1A1 P00352 2/20 0.55
L3MBTL1 Q9Y468 4/20 0.47
MAPK1 P28482 1/20 0.47
ASPH Q12797 1/20 0.47
KDM8 Q8N371 1/20 0.47
KMT2A Q03164 2/20 0.44
HIF1A Q16665 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
LMNA P02545 2/20 0.44
GLA P06280 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MEN1 O00255 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL110129 0.98 P4HTM (0.59) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL30449388 0.98 P4HTM (0.59) P4HTMP4HA1MIFKDM4EALDH1A1
Hydrochloric Acid SCHEMBL5223155 0.96 P4HTM (0.57) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL25412159 0.88 KMT2A (0.51) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL2636731 0.82 P4HTM (0.57) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL29928830 0.82 P4HTM (0.57) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL15440496 0.80 P4HTM (0.42) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL17447442 0.80 P4HTM (0.42) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL589084 0.78 ALDH1A1 (0.47) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL4860208 0.78 P4HTM (0.41) P4HTMP4HA1MIFKDM4EALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119591507-A Gem-difluorocyclopentane compounds and methods of synthesizing the same 南通大学 2025-03-11 CN claimed
CN-119591507-A Gem-difluorocyclopentane compounds and methods of synthesizing the same 南通大学 2025-03-11 CN disclosed