SCHEMBL19901920

SCHEMBL19901920

CC(O)c1ccc(Br)cc1C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.52
GLA P06280 1/20 0.52
MYC P01106 1/20 0.47
NR4A1 P22736 1/20 0.47
SORT1 Q99523 5/20 0.43
METAP2 P50579 1/20 0.43
GRIN1 Q05586 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2B Q13224 1/20 0.42
GRIN2C Q14957 1/20 0.42
GPR35 Q9HC97 1/20 0.42
POLB P06746 2/20 0.42
APEX1 P27695 1/20 0.41
CES2 O00748 1/20 0.41
GALR3 O60755 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
CASP1 P29466 1/20 0.41

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
SCHEMBL24680076 0.87 KDM4E (0.53) KDM4EGLAMYCNR4A1SORT1
SCHEMBL5502679 0.81 KDM4E (0.55) KDM4EGLAMYCNR4A1SORT1
SCHEMBL16395688 0.77 POLB (0.51) KDM4EGLAMYCNR4A1SORT1
SCHEMBL3490308 0.76 AKR1C3 (0.56) KDM4EGLAMYCNR4A1POLB
SCHEMBL3172075 0.76 KDM4E (0.50) KDM4EGLAMYCNR4A1SORT1
SCHEMBL16395691 0.76 POLB (0.50) KDM4EGLAMYCNR4A1SORT1
SCHEMBL17763436 0.76 POLB (0.50) KDM4EGLAMYCNR4A1SORT1
SCHEMBL6542407 0.76 GABRA1 (0.43) HPGDALOX15
SCHEMBL3194641 0.76 KDM4E (0.48) KDM4EGLAMYCNR4A1SORT1
SCHEMBL22552676 0.74 KDM4E (0.52) KDM4EGLAMYCNR4A1SORT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11148991-B2 5-bromo-2-(alpha-hydroxypentyl)benzoic acid sodium salts in different crystal forms, and preparation method thereof ZHEJIANG AUSUN PHARMACEUTICAL CO., LTD. (CN) 2021-10-19 US disclosed
US-10604471-B2 5-bromo-2-(alpha-hydroxypentyl)benzoic acid sodium salts in different crystal forms, and preparation method thereof ZHEJIANG AUSUN PHARMACEUTICAL CO., LTD. (CN) 2020-03-31 US disclosed
US-20190315673-A1 5-BROMO-2-(alpha-HYDROXYPENTYL)BENZOIC ACID SODIUM SALTS IN DIFFERENT CRYSTAL FORMS, AND PREPARATION METHOD THEREOF ZHEJIANG AUSUN PHARMACEUTICAL CO., LTD. (CN) 2019-10-17 US disclosed
US-10377693-B2 5-bromo-2-(α-hydroxypentyl)benzoic acid sodium salts in different crystal forms, and preparation method thereof ZHEJIANG AUSUN PHARMACEUTICAL CO., LTD. (CN) 2019-08-13 US disclosed
US-20190194116-A1 5-BROMO-2-(alpha-HYDROXYPENTYL)BENZOIC ACID SODIUM SALTS IN DIFFERENT CRYSTAL FORMS, AND PREPARATION METHOD THEREOF ZHEJIANG AUSUN PHARMACEUTICAL CO., LTD. (CN) 2019-06-27 US disclosed
US-20180127349-A1 5-BROMO-2-(alpha-HYDROXYPENTYL)BENZOIC ACID SODIUM SALTS IN DIFFERENT CRYSTAL FORMS, AND PREPARATION METHOD THEREOF ZHEJIANG AUSUN PHARMACEUTICAL CO., LTD. (CN) 2018-05-10 US disclosed
US-9902682-B2 5-bromo-2-(alpha-hydroxypentyl)benzoic acid sodium salts in different crystal forms, and preparation method thereof ZHEJIANG AUSUN PHARMACEUTICAL CO., LTD. (CN) 2018-02-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10377693-B2 5-bromo-2-(α-hydroxypentyl)benzoic acid sodium salts in different crystal forms, and preparation method thereof GABRA5, NPY5R, SCN5A KDM4E 953/4885GLA 622/4885MYC 4336/4885
US-20190315673-A1 5-BROMO-2-(alpha-HYDROXYPENTYL)BENZOIC ACID SODIUM SALTS IN DIFFERENT CRYSTAL FORMS, AND PREPARATION METHOD THEREOF GABRA5, NPY5R, SLC9A5 KDM4E 921/4885GLA 658/4885MYC 4408/4885
US-11148991-B2 5-bromo-2-(alpha-hydroxypentyl)benzoic acid sodium salts in different crystal forms, and preparation method thereof GABRA5, NPY5R, SLC9A5 KDM4E 921/4885GLA 658/4885MYC 4408/4885
US-10604471-B2 5-bromo-2-(alpha-hydroxypentyl)benzoic acid sodium salts in different crystal forms, and preparation method thereof GABRA5, NPY5R, SLC9A5 KDM4E 921/4885GLA 658/4885MYC 4408/4885
US-20180127349-A1 5-BROMO-2-(alpha-HYDROXYPENTYL)BENZOIC ACID SODIUM SALTS IN DIFFERENT CRYSTAL FORMS, AND PREPARATION METHOD THEREOF GABRA5, NPY5R, SLC9A5 KDM4E 921/4885GLA 658/4885MYC 4408/4885
US-20190194116-A1 5-BROMO-2-(alpha-HYDROXYPENTYL)BENZOIC ACID SODIUM SALTS IN DIFFERENT CRYSTAL FORMS, AND PREPARATION METHOD THEREOF GABRA5, NPY5R, SLC9A5 KDM4E 921/4885GLA 658/4885MYC 4408/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.