SCHEMBL28870296

SCHEMBL28870296

O=C(O)c1cc(C(=O)O)cc(-c2ccc(C(=O)c3ccccc3)cc2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 2/20 0.65
DHODH Q02127 2/20 0.65
MEN1 O00255 1/20 0.62
LMNA P02545 1/20 0.62
MAPT P10636 1/20 0.62
RAB9A P51151 1/20 0.62
KMT2A Q03164 1/20 0.62
ATM Q13315 2/20 0.59
TDP1 Q9NUW8 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
CA1 P00915 2/20 0.57
CA2 P00918 2/20 0.57
CA9 Q16790 2/20 0.57
KMO O15229 1/20 0.57
EGFR P00533 1/20 0.56
ALDH1A1 P00352 1/20 0.56
CDC25B P30305 1/20 0.53
CA12 O43570 1/20 0.53
CA14 Q9ULX7 1/20 0.53
CYP2C8 P10632 1/20 0.52

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
Benzophenone SCHEMBL1483016 0.87 SRD5A2 (0.86) SRD5A2MEN1LMNAMAPTRAB9A
SCHEMBL133482 0.87 RAB9A (0.72) SRD5A2MEN1LMNAMAPTRAB9A
SCHEMBL23671728 0.87 DHODH (0.81) DHODHMAPTKMOEGFRDAO
SCHEMBL28825956 0.86 ATM (0.69) SRD5A2DHODHMEN1LMNAMAPT
SCHEMBL14449092 0.86 ATM (0.75) SRD5A2MEN1LMNAMAPTRAB9A
SCHEMBL365949 0.85 SRD5A2 (0.73) SRD5A2MEN1KMT2AATMTDP1
SCHEMBL686581 0.85 RXRA (0.65) SRD5A2DHODHLMNACA1CA2
SCHEMBL1768904 0.85 DHODH (0.77) DHODHKMOEGFRDAOTSHR
SCHEMBL27736451 0.85 DHODH (0.77) DHODHKMOEGFRDAOTSHR
SCHEMBL16488615 0.85 DHODH (0.69) DHODHKMOEGFRRXRARXRB

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
CN-113501970-B Cadmium coordination polymer and composite membrane material thereof, preparation method and application 中原工学院 2022-08-19 CN disclosed