SCHEMBL8985359

SCHEMBL8985359

O=C(Cc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.59
RAB9A P51151 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
GSK3B P49841 1/20 0.56
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
POLB P06746 1/20 0.54
MAPT P10636 3/20 0.54
GAA P10253 2/20 0.54
PKM P14618 1/20 0.54
MAOA P21397 2/20 0.52
MAOB P27338 2/20 0.52
KCNJ1 P48048 1/20 0.50
KCNH2 Q12809 1/20 0.50
CES1 P23141 1/20 0.50
ALDH1A1 P00352 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C19 P33261 1/20 0.49
HSPB1 P04792 1/20 0.49

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
SCHEMBL1304505 0.84 RAB9A (0.64) NPC1RAB9ASMN1; SMN2GSK3BMEN1
SCHEMBL6201900 0.84 RAB9A (0.59) NPC1RAB9ASMN1; SMN2MAPTGAA
SCHEMBL28872876 0.84 PKM (0.62) NPC1RAB9ASMN1; SMN2GSK3BMEN1
SCHEMBL668743 0.84 NPC1 (0.63) NPC1RAB9ASMN1; SMN2GSK3BMEN1
SCHEMBL199347 0.83 CRHBP (0.62) NPC1RAB9ASMN1; SMN2GSK3BMEN1
SCHEMBL4319309 0.83 CES2 (0.61) NPC1RAB9AGSK3BMEN1KMT2A
SCHEMBL3672574 0.83 POLB (0.57) GSK3BMEN1KMT2APOLBMAPT
SCHEMBL6159093 0.82 NPC1 (0.61) NPC1RAB9ASMN1; SMN2GSK3BMEN1
SCHEMBL20491340 0.82 GAA (0.53) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL28021892 0.81 MAPT (0.54) GSK3BMEN1KMT2AMAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260124204-A1 METALLOENZYME INHIBITOR COMPOUNDS EIKONIZO THERAPEUTICS, INC. (US) 2026-05-07 US disclosed
US-12370194-B2 Metalloenzyme inhibitor compounds EIKONIZO THERAPEUTICS, INC. (US) 2025-07-29 US disclosed
US-20240307391-A1 METALLOENZYME INHIBITOR COMPOUNDS EIKONIZO THERAPEUTICS, INC. (US) 2024-09-19 US disclosed
US-11938134-B2 Metalloenzyme inhibitor compounds EIKONIZO THERAPEUTICS, INC. (US) 2024-03-26 US disclosed
US-20220088018-A1 METALLOENZYME INHIBITOR COMPOUNDS EIKONIZO THERAPEUTICS, INC. (US) 2022-03-24 US disclosed
US-20200171028-A1 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS HOLDINGS, LLC 2020-06-04 US disclosed
US-10357493-B2 Metalloenzyme inhibitor compounds SELENITY THERAPEUTICS (BERMUDA), LTD. (BM) 2019-07-23 US disclosed
US-20180256572-A1 METALLOENZYME INHIBITOR COMPOUNDS VPS-3, INC. (US) 2018-09-13 US disclosed
CN-100503562-C Pyrrolidone derivatives as MAOB inhibitors HOFFMANN LA ROCHE (CH) 2009-06-24 CN disclosed
CN-1681777-A Pyrrolidone derivatives as MAOB inhibitors HOFFMANN LA ROCHE (CH) 2005-10-12 CN disclosed
US-5571810-A ANTIINFLAMMATORY AGENTS, ANALGESICS, COLLAGEN DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-11-05 US disclosed
EP-0593761-A1 NEW THIOPHENE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-04-27 EP disclosed
WO-1991019708-A1 NEW THIOPHENE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-12-26 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 (8 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-20240307391-A1 METALLOENZYME INHIBITOR COMPOUNDS HDAC6, HDAC1, HDAC2 NPC1 320/4885RAB9A 1505/4885SMN1; SMN2 447/4885
US-20220088018-A1 METALLOENZYME INHIBITOR COMPOUNDS HDAC6, HDAC1, HDAC2 NPC1 320/4885RAB9A 1505/4885SMN1; SMN2 447/4885
US-20180256572-A1 METALLOENZYME INHIBITOR COMPOUNDS HDAC6, HDAC1, HDAC2 NPC1 320/4885RAB9A 1505/4885SMN1; SMN2 447/4885
US-20200171028-A1 METALLOENZYME INHIBITOR COMPOUNDS HDAC6, HDAC1, HDAC2 NPC1 320/4885RAB9A 1505/4885SMN1; SMN2 447/4885
US-20260124204-A1 METALLOENZYME INHIBITOR COMPOUNDS HDAC6, HDAC3, HDAC1 NPC1 710/4885RAB9A 340/4885SMN1; SMN2 2245/4885
US-11938134-B2 Metalloenzyme inhibitor compounds HDAC6, HDAC1, HDAC2 NPC1 320/4885RAB9A 1505/4885SMN1; SMN2 447/4885
US-10357493-B2 Metalloenzyme inhibitor compounds HDAC6, HDAC1, HDAC2 NPC1 320/4885RAB9A 1505/4885SMN1; SMN2 447/4885
US-12370194-B2 Metalloenzyme inhibitor compounds HDAC6, HDAC1, HDAC2 NPC1 320/4885RAB9A 1505/4885SMN1; SMN2 447/4885

“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.