SCHEMBL17620194

SCHEMBL17620194

NS(=O)(=O)c1ccc(N2C(=O)c3cccc4c(Br)ccc(c34)C2=O)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 12/20 0.68
CA2 P00918 12/20 0.68
CA9 Q16790 11/20 0.68
CA12 O43570 10/20 0.68
SCN2A Q99250 1/20 0.64
CA7 P43166 2/20 0.54
USP2 O75604 2/20 0.51
KMT2A Q03164 2/20 0.51
KEAP1 Q14145 2/20 0.51
NFE2L2 Q16236 2/20 0.51
ALDH1A1 P00352 2/20 0.51
CYP1B1 Q16678 2/20 0.51
KDM4E B2RXH2 1/20 0.51
MAPT P10636 1/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
MEN1 O00255 1/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
ATM Q13315 1/20 0.51

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
SCHEMBL19429344 0.85 CA2 (0.67) CA1CA2CA9CA12SCN2A
SCHEMBL1518037 0.83 ALDH1A1 (0.68) USP2KMT2AKEAP1NFE2L2ALDH1A1
SCHEMBL14159196 0.82 POLB (0.63) USP2KMT2AKEAP1NFE2L2ALDH1A1
SCHEMBL1517977 0.82 ALDH1A1 (0.65) USP2KMT2AKEAP1NFE2L2ALDH1A1
SCHEMBL17620197 0.81 CA2 (1.00) CA1CA2CA9CA12SCN2A
SCHEMBL18347260 0.80 CA2 (0.87) CA1CA2CA9CA12SCN2A
SCHEMBL1548435 0.79 CA2 (1.00) CA1CA2CA9CA12SCN2A
SCHEMBL5159240 0.79 KDM4E (0.56) CA1CA2CA9CA12SCN2A
SCHEMBL31214038 0.79 CYP1B1 (0.65) USP2KMT2AKEAP1NFE2L2ALDH1A1
SCHEMBL28406753 0.78 CYP1B1 (0.55) CA1CA2CA9CA12USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170283408-A1 BENZO-HETEROCYCLIC COMPOUNDS AND THEIR APPLICATIONS Lu, Yen-Ta (TW) 2017-10-05 US claimed
US-11685785-B2 Methods and antibodies for modulation of immunoresponse Ascendo Biotechnology, Inc. (KY) 2023-06-27 US disclosed
EP-3194368-B1 BENZO-HETEROCYCLIC COMPOUNDS AND THEIR APPLICATIONS MACKAY MEDICAL FOUND THE PRESBYTERIAN CHURCH IN TAIWAN MACKAY MEMORIAL HOSPITAL (TW) 2020-12-23 EP disclosed
EP-3194368-B1 BENZO-HETEROCYCLIC COMPOUNDS AND THEIR APPLICATIONS MACKAY MEDICAL FOUND THE PRESBYTERIAN CHURCH IN TAIWAN MACKAY MEMORIAL HOSPITAL (TW) 2020-12-23 EP disclosed
US-20200339557-A1 BENZO-HETEROCYCLIC COMPOUNDS AND THEIR APPLICATIONS MACKAY MEDICAL FOUNDATION THE PRESBYTERIAN CHURCH IN TAIWAN MACKAY MEMORIAL HOSPITAL (TW) 2020-10-29 US disclosed
US-20200339557-A1 BENZO-HETEROCYCLIC COMPOUNDS AND THEIR APPLICATIONS MACKAY MEDICAL FOUNDATION THE PRESBYTERIAN CHURCH IN TAIWAN MACKAY MEMORIAL HOSPITAL (TW) 2020-10-29 US disclosed
US-20170283408-A1 BENZO-HETEROCYCLIC COMPOUNDS AND THEIR APPLICATIONS Lu, Yen-Ta (TW) 2017-10-05 US disclosed
US-20170283408-A1 BENZO-HETEROCYCLIC COMPOUNDS AND THEIR APPLICATIONS Lu, Yen-Ta (TW) 2017-10-05 US disclosed
US-20170283408-A1 BENZO-HETEROCYCLIC COMPOUNDS AND THEIR APPLICATIONS Lu, Yen-Ta (TW) 2017-10-05 US disclosed
WO-2016197974-A1 METHODS AND ANTIBODIES FOR MODULATION OF IMMUNORESPONSE LU YEN-TA (CN) 2016-12-15 WO disclosed
WO-2016041511-A1 BENZO-HETEROCYCLIC COMPOUNDS AND THEIR APPLICATIONS LU YEN-TA (CN) 2016-03-24 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 (3 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-20200339557-A1 BENZO-HETEROCYCLIC COMPOUNDS AND THEIR APPLICATIONS CD274, PDCD1, PDCD1LG2 CA1 2827/4885CA2 2201/4885CA9 966/4885
US-20170283408-A1 BENZO-HETEROCYCLIC COMPOUNDS AND THEIR APPLICATIONS CD274, PDCD1, PDCD1LG2 CA1 2827/4885CA2 2201/4885CA9 966/4885
US-11685785-B2 Methods and antibodies for modulation of immunoresponse CD47, CD274, CD69 CA1 3668/4885CA2 4720/4885CA9 4250/4885

“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.