SCHEMBL28299518

SCHEMBL28299518

O=C(O)OC(=O)c1cccc(C(=O)OC(=O)O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.50
ATM Q13315 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
F2 P00734 1/20 0.46
LMNA P02545 1/20 0.46
TSHR P16473 2/20 0.43
UNG P13051 1/20 0.42
RAB9A P51151 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA6 P23280 1/20 0.41
CA9 Q16790 1/20 0.41
AKR1C3 P42330 1/20 0.41
DAO P14920 1/20 0.40
NAPRT Q6XQN6 1/20 0.40
LOXL2 Q9Y4K0 1/20 0.40
CES2 O00748 1/20 0.40
CES1 P23141 1/20 0.40
ALDH1A1 P00352 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
SCHEMBL27589781 0.90 TSHR (0.61) TSHRRAB9ACA12CA1CA2
SCHEMBL545343 0.86 LMNA (0.58) L3MBTL1ATMTDP1F2LMNA
SCHEMBL9304626 0.86 AKR1C3 (0.61) L3MBTL1RAB9AAKR1C3CES2CES1
SCHEMBL4260982 0.85 LMNA (0.64) L3MBTL1TDP1F2LMNATSHR
SCHEMBL27504 0.84 CA12 (0.56) L3MBTL1ATMTDP1TSHRUNG
SCHEMBL5689369 0.84 CA12 (0.56) L3MBTL1ATMTDP1TSHRUNG
Isophthalic Acid SCHEMBL20500517 0.84 CA12 (0.56) L3MBTL1ATMTDP1TSHRUNG
Isophthalic Acid SCHEMBL5689366 0.84 CA12 (0.56) L3MBTL1ATMTDP1TSHRUNG
SCHEMBL28061836 0.83 LMNA (0.61) L3MBTL1TDP1F2LMNATSHR
SCHEMBL27955112 0.83 LMNA (0.61) L3MBTL1TDP1F2LMNATSHR

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-115505112-B Low-cost low-light type polyester resin for powder coating and preparation method thereof 安徽永利新材料科技有限公司 2023-09-19 CN disclosed
CN-109867311-A Using Co-Li bimetallic MOFs material as the method for precursor preparation lithium cobalt oxide cathode material for lithium ion battery 河南师范大学 2019-06-11 CN disclosed