SCHEMBL6305986

SCHEMBL6305986

Cc1sc2ccc(C(=O)O)cc2c1Cc1ccc(Br)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
TBXAS1 P24557 3/20 0.38
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PTGFR P43088 4/20 0.36
PLA2G4A P47712 1/20 0.36
LTB4R Q15722 1/20 0.36
EPHX2 P34913 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
PTGER1 P34995 2/20 0.35
RECQL P46063 1/20 0.34
SIRT5 Q9NXA8 1/20 0.34
HPGD P15428 2/20 0.34
POLB P06746 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
SLC22A12 Q96S37 2/20 0.34
THRB P10828 1/20 0.33
SRD5A1 P18405 1/20 0.33

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
SCHEMBL6299012 0.88 NR4A2 (0.44) ALDH1A1KDM4ETBXAS1NPC1RAB9A
SCHEMBL6299179 0.88 PFKFB3 (0.45) ALDH1A1NPC1RAB9ASMN1; SMN2TSHR
SCHEMBL6300210 0.85 SLC22A12 (0.42) ALDH1A1KDM4ETBXAS1NPC1RAB9A
SCHEMBL6298858 0.84 ACLY (0.38) ALDH1A1KDM4ETBXAS1SMN1; SMN2LTB4R
SCHEMBL6299476 0.82 PTGER4 (0.39) ALDH1A1KDM4ETBXAS1NPC1RAB9A
SCHEMBL6300093 0.81 MRGPRX4 (0.40) ALDH1A1KDM4ETBXAS1NPC1RAB9A
SCHEMBL6299196 0.81 SLC22A12 (0.47) ALDH1A1TBXAS1NPC1RAB9ASMN1; SMN2
SCHEMBL6299406 0.79 PPARG (0.46) NR1H4
SCHEMBL6301167 0.78 KDM4E (0.38) ALDH1A1KDM4ETBXAS1NPC1RAB9A
SCHEMBL6306599 0.78 TSHR (0.45) ALDH1A1TBXAS1NPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6911469-B2 Sulfonamide compounds and pharmaceutical use thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-06-28 US disclosed
US-20040180947-A1 hypoglycemic activity or phoshodiesterase-V inhibitory activity; prophylaxis and treatment of impaired glucose tolerance disorder, diabetes (e.g., type II diabetes), diabetic complications FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-09-16 US disclosed
US-20020099212-A1 For therapy of disease treatable based on a blood sugar level-depressing activity or a disease treatable based on a cGMP-PDE inhibiting activity, smooth muscle relaxing activity, bronchodilating activity, vasodilating activity FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2002-07-25 US disclosed
US-6348474-B1 COMPOUNDS AS ANTIDIABETIC AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-02-19 US disclosed
EP-0995742-A1 SULFONAMIDE COMPOUNDS AND MEDICINAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-04-26 EP 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 (2 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-20020099212-A1 For therapy of disease treatable based on a blood sugar level-depressing activity or a disease treatable based on a cGMP-PDE inhibiting activity, smooth muscle relaxing activity, bronchodilating activity, vasodilating activity PDE2A, PDE3A, PDE12 ALDH1A1 570/4885KDM4E 1305/4885TBXAS1 901/4885
US-20040180947-A1 hypoglycemic activity or phoshodiesterase-V inhibitory activity; prophylaxis and treatment of impaired glucose tolerance disorder, diabetes (e.g., type II diabetes), diabetic complications PDE2A, PDE3A, PYGM ALDH1A1 1067/4885KDM4E 935/4885TBXAS1 910/4885

“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.