SCHEMBL312791

SCHEMBL312791

O=C(O)c1ccc(O)c(Br)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 4/20 0.64
▸ CA1 P00915 4/20 0.64
▸ CA2 P00918 4/20 0.64
▸ CA6 P23280 4/20 0.64
▸ CA9 Q16790 4/20 0.64
▸ CA4 P22748 3/20 0.64
▸ CA7 P43166 3/20 0.64
▸ CA14 Q9ULX7 3/20 0.64
▸ KDM4E B2RXH2 3/20 0.64
▸ MAPT P10636 2/20 0.64
▸ POLB P06746 1/20 0.64
▸ GAA P10253 1/20 0.64
▸ PTGS2 P35354 1/20 0.64
▸ L3MBTL1 Q9Y468 1/20 0.64
▸ TTR P02766 1/20 0.58
▸ HTT P42858 1/20 0.52
▸ ALOX15 P16050 1/20 0.50
▸ ESR1 P03372 1/20 0.49
▸ KDM5A P29375 2/20 0.48
▸ TPMT P51580 1/20 0.48

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
SCHEMBL30436340 1.00 CA12 (0.64) CA12CA1CA2CA6CA9
SCHEMBL29748630 0.84 ALDH1A1 (0.53) CA12CA1CA2CA6CA9
SCHEMBL3688519 0.84 KDM4E (0.62) CA12CA1CA2CA6CA9
SCHEMBL1812684 0.82 CA12 (0.64) CA12CA1CA2CA6CA9
SCHEMBL29810232 0.81 TTR (0.56) CA12CA1CA2CA6CA9
SCHEMBL588825 0.81 TTR (0.56) CA12CA1CA2CA6CA9
Bromide SCHEMBL6507901 0.80 CA12 (0.61) CA12CA1CA2CA6CA9
SCHEMBL985272 0.80 PKM (0.55) CA1CA2MAPTPOLBHTT
SCHEMBL2824995 0.80 LCK (0.53) CA12CA1CA2CA9CA14
SCHEMBL4900937 0.80 ALOX15 (0.48) CA12CA1CA2CA6CA9

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 733 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118549570-A Detection method of 13 disinfection byproducts in sediment 上海市环境科学研究院 2024-08-27 — — CN claimed
CN-118184679-A Photothermal agent and preparation method thereof, photothermal nanoparticle and preparation method thereof, insulating material and self-repairing method of insulating material 中国石油天然气股份有限公司 2024-06-14 — — CN claimed
CN-117701479-B Bacterial strain capable of degrading benzonitrile herbicide, microbial agent and application thereof 华南农业大学 2024-04-12 — — CN claimed
CN-114113370-B Analysis method of aromatic halogenated disinfection byproducts in water 东南大学 2024-03-26 — — CN claimed
CN-115722210-B Recursive nanofiber-based detection material and preparation method and application thereof 广西大学 2024-02-20 — — CN claimed
CN-114015704-B 3-bromo-4-hydroxybenzoic acid oxidase gene cluster phbh2pcaA2B2 and application thereof 南京农业大学 2023-05-26 — — CN claimed
CN-113862199-B Degrading strain of benzonitrile herbicide and microbial inoculum produced by degrading strain 南京农业大学 2023-03-07 — — CN claimed
CN-115722210-A Recursive nanofiber-based detection material and preparation method and application thereof 广西大学 2023-03-03 — — CN claimed
CN-114113370-A Analysis method of aromatic halogenated disinfection byproducts in water 东南大学 2022-03-01 — — CN claimed
CN-114015704-A 3-bromo-4-hydroxybenzoic acid oxidase gene cluster phbh2pcaA2B2 and application thereof 南京农业大学 2022-02-08 — — CN claimed
EP-0383177-A2 Cross-linkable thermotropic liquid crystalline aromatic polyesters HIMONT ITALIA S.r.l. (IT) 1990-08-22 — — EP claimed
US-4923947-A Thermotropic liquid crystalline aromatic polyesters of disubstituted 4,4'-dihydroxydiphenylene MONTEDISON S.P.A. (IT) 1990-05-08 — — US claimed
US-4923955-A Thermotropic liquid-crystalline aromatic polyesters of substituted 4,4'-dihydroxy-diphenylene MONTEDISON S.P.A. (IT) 1990-05-08 — — US claimed
US-4874800-A BLENDED WITH POLYAMIDE TREATED FILLER; HIGH STRENGTH, HEAT RESISTANCE POLYPLASTICS CO., LTD. (JP) 1989-10-17 — — US claimed
EP-0324608-A2 Thermotropic liquid crystalline aromatic polyesters Montedison S.p.A. (IT) 1989-07-19 — — EP claimed
EP-0323710-A1 Thermotropic liquid crystalline aromatic polyesters Montedison S.p.A. (IT) 1989-07-12 — — EP claimed
EP-0321107-A1 Thermotropic liquid-crystalline aromatic polyesters HIMONT ITALIA S.r.l. (IT) 1989-06-21 — — EP claimed
US-4737398-A POLYAZOMETHYNE, POLYESTER OR POLYCARBONATE POLYPLASTICS CO., LTD. (JP) 1988-04-12 — — US claimed
US-4726998-A LIQUID CRYSTAL POLYMER SUBSTRATE, MAGNETIC LAYER POLYPLASTICS CO., LTD. (JP) 1988-02-23 — — US claimed
US-4447593-A HIGH STRENGTH; MELT-SHAPEABLE; TEIJIN LIMITED (JP) 1984-05-08 — — US claimed
Send feedback