SCHEMBL378550

SCHEMBL378550

COc1cc(OC)cc(-c2nc3ccc(N)cc3c(=O)[nH]2)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.53
TNKS O95271 2/20 0.53
PARP1 P09874 2/20 0.53
TNKS2 Q9H2K2 2/20 0.53
GUSB P08236 2/20 0.53
RAB9A P51151 2/20 0.53
CASP3 P42574 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
KDM4E B2RXH2 2/20 0.50
LMNA P02545 2/20 0.50
ALDH1A1 P00352 2/20 0.50
MEN1 O00255 2/20 0.50
TP53 P04637 2/20 0.50
POLB P06746 2/20 0.50
PKM P14618 2/20 0.50
HPGD P15428 2/20 0.50
KMT2A Q03164 2/20 0.50
HSD17B10 Q99714 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL17786340 0.90 TNKS (0.67) NPC1TNKSPARP1TNKS2GUSB
SCHEMBL17786622 0.89 NPC1 (0.59) NPC1TNKSPARP1TNKS2GUSB
SCHEMBL259490 0.88 KDM4E (0.65) NPC1TNKSPARP1TNKS2GUSB
SCHEMBL28645325 0.82 GUSB (0.77) NPC1TNKSPARP1TNKS2GUSB
SCHEMBL17786541 0.82 GUSB (0.71) NPC1TNKSPARP1TNKS2GUSB
SCHEMBL11120468 0.82 TNKS (0.72) NPC1TNKSPARP1TNKS2GUSB
SCHEMBL29963902 0.82 TNKS (0.72) NPC1TNKSPARP1TNKS2GUSB
SCHEMBL11311043 0.80 TNKS (0.70) NPC1TNKSPARP1TNKS2GUSB
SCHEMBL147895 0.79 TNKS (0.50) NPC1TNKSPARP1TNKS2GUSB
SCHEMBL17786592 0.79 CHEK2 (0.57) NPC1TNKSPARP1TNKS2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2408454-B1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP (CA) 2024-07-24 EP disclosed
US-11407719-B2 Anti-inflammatory agents RESVERLOGIX CORP. (CA) 2022-08-09 US disclosed
US-20210070716-A1 ANTI-INFLAMMATORY AGENTS HEPALINK (HONG KONG) LIMITED (HK) 2021-03-11 US disclosed
US-10882828-B2 Anti-inflammatory agents RESVERLOGIX CORP. (CA) 2021-01-05 US disclosed
US-20190119222-A1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2019-04-25 US disclosed
US-10131640-B2 Anti-inflammatory agents RESVERLOGIX CORP. (CA) 2018-11-20 US disclosed
CN-105859639-A NOVEL ANTI-INFLAMMATORY AGENTS 雷斯韦洛吉克斯公司 2016-08-17 CN disclosed
WO-2016083490-A1 COMPOUNDS FOR THE TREATMENT OF AMYLOID-ASSOCIATED DISEASES REMYND NV (BE) 2016-06-02 WO disclosed
US-20160137613-A1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2016-05-19 US disclosed
US-9238640-B2 Anti-inflammatory agents RESVERLOGIX CORP. (CA) 2016-01-19 US disclosed
CN-102427813-A Novel anti-inflammatory agents RESVERLOGIX CORP 2012-04-25 CN disclosed
US-20120040954-A1 NOVEL ANTI-INFLAMMATORY AGENTS HEPALINK (HONG KONG) LIMITED (HK) 2012-02-16 US disclosed
EP-2408454-A2 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2012-01-25 EP disclosed
WO-2010106436-A2 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2010-09-23 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 (7 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-11407719-B2 Anti-inflammatory agents VCAM1, ICAM1, IL6 NPC1 2953/4885TNKS 1152/4885PARP1 1156/4885
US-20160137613-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 NPC1 2904/4885TNKS 1051/4885PARP1 1176/4885
US-10882828-B2 Anti-inflammatory agents VCAM1, ICAM1, IL6 NPC1 2953/4885TNKS 1152/4885PARP1 1156/4885
US-20210070716-A1 ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 NPC1 2953/4885TNKS 1152/4885PARP1 1156/4885
US-10131640-B2 Anti-inflammatory agents VCAM1, ICAM1, IL6 NPC1 2953/4885TNKS 1152/4885PARP1 1156/4885
US-20190119222-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 NPC1 2904/4885TNKS 1051/4885PARP1 1176/4885
US-20120040954-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 NPC1 2904/4885TNKS 1051/4885PARP1 1176/4885

“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.