SCHEMBL2225522

SCHEMBL2225522

O=C(O)c1ncc(-c2ccccc2)cn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.54
NPC1 O15118 2/20 0.54
NFKB1 P19838 2/20 0.54
RAB9A P51151 2/20 0.54
NFKB2 Q00653 2/20 0.54
RELA Q04206 2/20 0.54
LDHA P00338 2/20 0.47
PIN1 Q13526 1/20 0.46
MAP4K4 O95819 1/20 0.45
ATM Q13315 1/20 0.44
KMO O15229 2/20 0.42
USP30 Q70CQ3 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 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
SCHEMBL30526873 0.91 NPC1 (0.43) SMN1; SMN2NPC1NFKB1RAB9ANFKB2
Biphenyl SCHEMBL27870412 0.84 L3MBTL1 (0.52) SMN1; SMN2NPC1RAB9ALDHAKMO
SCHEMBL13394467 0.83 NAPRT (0.46) MAP4K4KDM4EMKNK1MKNK2
SCHEMBL27163064 0.83 SMN1; SMN2 (0.52) SMN1; SMN2NPC1NFKB1RAB9ANFKB2
SCHEMBL4465941 0.81 BCL2L1 (0.55) NPC1MAP4K4KMOKDM4E
SCHEMBL3308502 0.81 NAPRT (0.45) MAP4K4KDM4EMKNK1MKNK2
SCHEMBL4459958 0.81 KMO (0.60) SMN1; SMN2PIN1MAP4K4KMOKDM4E
Biphenyl SCHEMBL28790863 0.80 KMO (0.44) SMN1; SMN2LDHAPIN1ATMKMO
SCHEMBL25184597 0.79 KMO (0.59) SMN1; SMN2NPC1RAB9APIN1MAP4K4
SCHEMBL21504745 0.78 CYP4F2 (0.61) SMN1; SMN2NPC1NFKB1RAB9ANFKB2

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 62 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112279888-B Polypeptide inhibitor of APC/Asef interaction and application thereof 上海交通大学医学院 2022-09-13 CN claimed
US-12637426-B2 1-cyano-pyrrolidine compounds as USP30 inhibitors MISSION THERAPEUTICS LIMITED (GB) 2026-05-26 US disclosed
US-20260083851-A1 POTENT ASGPR-BINDING HETEROBIFUNCTIONAL COMPOUNDS FOR THE DEGRADATION OF IMMUNOGLOBULINS AND OTHER PROTEINS AVILAR THERAPEUTICS, INC. (US) 2026-03-26 US disclosed
WO-2024098039-A2 POTENT ASGPR-BINDING HETEROBIFUNCTIONAL COMPOUNDS FOR THE DEGRADATION OF IMMUNOGLOBULINS AND OTHER PROTEINS AVILAR THERAPEUTICS, INC. (US) 2024-05-10 WO disclosed
CN-112707893-B 1-cyanopyrrolidine compounds as USP30 inhibitors 特殊治疗有限公司 2023-10-31 CN disclosed
CN-112279888-B Polypeptide inhibitor of APC/Asef interaction and application thereof 上海交通大学医学院 2022-09-13 CN disclosed
US-20220251041-A1 1-CYANO-PYRROLIDINE COMPOUNDS AS USP30 INHIBITORS MISSION THERAPEUTICS LTD (GB) 2022-08-11 US disclosed
US-11390584-B2 1-cyano-pyrrolidine compounds as USP30 inhibitors MISSION THERAPEUTICS LIMITED (GB) 2022-07-19 US disclosed
EP-3943490-A1 1-CYANO-PYRROLIDINE COMPOUNDS AS USP30 INHIBITORS Mission Therapeutics Limited (GB) 2022-01-26 EP disclosed
EP-3943490-A1 1-CYANO-PYRROLIDINE COMPOUNDS AS USP30 INHIBITORS Mission Therapeutics Limited (GB) 2022-01-26 EP disclosed
CN-100448870-C 2-aminoquinoline derivative BANYU PHARMA CO LTD (JP) 2009-01-07 CN disclosed
CN-100418965-C Imidazopyridine derivatives BANYU PHARMA CO LTD (JP) 2008-09-17 CN disclosed
US-20080200494-A1 Imidazopyridine Derivatives MSD K.K. (JP) 2008-08-21 US disclosed
US-20080021035-A1 Myosin light chain kinase inhibitor compounds, compostions and related methods of use NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-01-24 US disclosed
US-20080021035-A1 Myosin light chain kinase inhibitor compounds, compostions and related methods of use NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-01-24 US disclosed
US-20060287340-A1 2-Aminoquinoline derivatives MSD K.K. (JP) 2006-12-21 US disclosed
CN-1835950-A Imidazopyridine derivatives BANYU PHARMA CO LTD (JP) 2006-09-20 CN disclosed
CN-1791594-A 2-aminoquinoline derivatives BANYU PHARMA CO LTD (JP) 2006-06-21 CN disclosed
EP-1657242-A1 IMIDAZOPYRIDINE DERIVATIVES Banyu Pharmaceutical Co., Ltd. (JP) 2006-05-17 EP disclosed
EP-1630162-A1 2-AMINOQUINOLINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-03-01 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 (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-20080021035-A1 Myosin light chain kinase inhibitor compounds, compostions and related methods of use MYLK, MYLK3, MYLK2 SMN1; SMN2 2594/4885NPC1 4879/4885NFKB1 3614/4885
US-20080200494-A1 Imidazopyridine Derivatives MC1R, MC3R, MC5R SMN1; SMN2 2050/4885NPC1 2382/4885NFKB1 4234/4885
US-20060287340-A1 2-Aminoquinoline derivatives MCHR2, MC2R, MCHR1 SMN1; SMN2 2295/4885NPC1 931/4885NFKB1 2872/4885
US-20220251041-A1 1-CYANO-PYRROLIDINE COMPOUNDS AS USP30 INHIBITORS USP30, USP20, USP10 SMN1; SMN2 3078/4885NPC1 2884/4885NFKB1 541/4885
US-20260083851-A1 POTENT ASGPR-BINDING HETEROBIFUNCTIONAL COMPOUNDS FOR THE DEGRADATION OF IMMUNOGLOBULINS AND OTHER PROTEINS ASGR1, FCGR2A, FCGR3B SMN1; SMN2 4035/4885NPC1 746/4885NFKB1 4178/4885
US-12637426-B2 1-cyano-pyrrolidine compounds as USP30 inhibitors USP30, USP1, USP10 SMN1; SMN2 2487/4885NPC1 1961/4885NFKB1 1157/4885
US-11390584-B2 1-cyano-pyrrolidine compounds as USP30 inhibitors USP30, USP20, USP10 SMN1; SMN2 3239/4885NPC1 2802/4885NFKB1 512/4885

“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.