SCHEMBL18664403

SCHEMBL18664403

N#Cc1ccc(-c2ccc(O)cc2Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 1/20 0.57
ESR1 P03372 10/20 0.56
ESR2 Q92731 6/20 0.56
CA12 O43570 1/20 0.52
CA2 P00918 1/20 0.52
CA3 P07451 1/20 0.52
CA6 P23280 1/20 0.52
CA9 Q16790 1/20 0.52
CA14 Q9ULX7 1/20 0.52
HSD17B1 P14061 1/20 0.49
HSD17B2 P37059 1/20 0.49
AR P10275 1/20 0.49
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
CYP19A1 P11511 1/20 0.43
MIF P14174 1/20 0.43
HSD17B10 Q99714 1/20 0.42
CHEK1 O14757 1/20 0.41
WEE1 P30291 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
SCHEMBL18664451 0.89 MMP3 (0.57) MMP3ESR1ESR2CA12CA2
SCHEMBL31463157 0.83 MMP3 (0.47) MMP3CA12CA2CA9
SCHEMBL6068004 0.83 MMP3 (0.63) MMP3ESR2CA12CA2CA3
SCHEMBL3684267 0.82 ESR1 (0.70) ESR1ESR2HSD17B1HSD17B2HSD17B10
SCHEMBL2786845 0.79 ESR2 (0.59) MMP3ESR1ESR2CA12CA2
SCHEMBL83335 0.79 MMP3 (0.57) MMP3ESR1ESR2CA12CA2
SCHEMBL31602535 0.79 MAOB (0.43) MMP3MAOAMAOB
SCHEMBL17629923 0.79 EGLN2 (0.43) MMP3CA12CA2CA9
SCHEMBL17630026 0.79 KDM1A (0.41) MMP3MAOAMAOB
SCHEMBL17643479 0.78 AHR (0.47) MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11384055-B2 Glycolate oxidase inhibitors for the treatment of disease BIOMARIN PHARMACEUTICAL INC. (US) 2022-07-12 US disclosed
EP-3349581-B1 HEPATITIS B CORE PROTEIN MODULATORS ASSEMBLY BIOSCIENCES INC (US) 2021-12-01 EP disclosed
EP-3349581-B1 HEPATITIS B CORE PROTEIN MODULATORS ASSEMBLY BIOSCIENCES INC (US) 2021-12-01 EP disclosed
US-20210171474-A1 GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE BIOMARIN PHARMACEUTICAL INC. (US) 2021-06-10 US disclosed
WO-2020257487-A1 GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE BIOMARIN PHARMACEUTICAL INC. (US) 2020-12-24 WO disclosed
US-10766890-B2 Hepatitis B core protein modulators ASSEMBLY BIOSCIENCES, INC. (US) 2020-09-08 US disclosed
US-10766890-B2 Hepatitis B core protein modulators ASSEMBLY BIOSCIENCES, INC. (US) 2020-09-08 US disclosed
US-20180265484-A1 HEPATITIS B CORE PROTEIN MODULATORS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION 2018-09-20 US disclosed
WO-2017048962-A1 HEPATITIS B CORE PROTEIN MODULATORS ASSEMBLY BIOSCIENCES, INC. (US) 2017-03-23 WO 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 (4 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-20180265484-A1 HEPATITIS B CORE PROTEIN MODULATORS HAVCR2, FABP1, MAVS MMP3 4619/4885ESR1 2250/4885ESR2 1652/4885
US-11384055-B2 Glycolate oxidase inhibitors for the treatment of disease XDH, PNPO, AGXT MMP3 1010/4885ESR1 4626/4885ESR2 4547/4885
US-20210171474-A1 GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE XDH, PNPO, AGXT MMP3 1010/4885ESR1 4626/4885ESR2 4547/4885
US-10766890-B2 Hepatitis B core protein modulators HAVCR2, FABP1, MAVS MMP3 4619/4885ESR1 2250/4885ESR2 1652/4885

“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.