SCHEMBL362014

SCHEMBL362014

C=CCOc1cc([N+](=O)[O-])ccc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.50
PDE7A Q13946 1/20 0.43
VCAM1 P19320 1/20 0.43
MAPT P10636 6/20 0.42
HPGD P15428 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
LMNA P02545 3/20 0.42
KMT2A Q03164 2/20 0.42
RAB9A P51151 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
ALDH1A1 P00352 2/20 0.42
NPC1 O15118 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
GAA P10253 1/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 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
SCHEMBL30764047 1.00 HSD17B10 (0.50) HSD17B10PDE7AVCAM1MAPTHPGD
SCHEMBL16711719 0.88 MAPT (0.54) HSD17B10PDE7AMAPTHPGDSMN1; SMN2
SCHEMBL4180320 0.83 ERN1 (0.49) MAPTHPGDSMN1; SMN2KMT2AALDH1A1
SCHEMBL9838306 0.83 HTT (0.57) PDE7AMAPTLMNAKMT2ARAB9A
SCHEMBL5668088 0.83 GPR35 (0.45) MAPTHPGDSMN1; SMN2LMNAKMT2A
SCHEMBL25405022 0.82 HTT (0.41) MAPTHPGDLMNAKMT2ARAB9A
SCHEMBL27631030 0.82 ALDH1A1 (0.50) PDE7AMAPTLMNAKMT2ARAB9A
SCHEMBL27452313 0.82 HTT (0.41) PDE7AMAPTHPGDSMN1; SMN2LMNA
SCHEMBL6825718 0.81 RAB9A (0.46) HSD17B10PDE7AMAPTHPGDSMN1; SMN2
SCHEMBL4359591 0.81 HTT (0.54) MAPTHPGDSMN1; SMN2LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4592286-A1 MACROCYCLIC NITROGEN-CONTAINING CROWN ETHER COMPOUND AND USE THEREOF AS PROTEIN KINASE INHIBITOR Artivila Biopharma (CN) 2025-07-30 EP disclosed
WO-2024061118-A1 MACROCYCLIC NITROGEN-CONTAINING CROWN ETHER COMPOUND AND USE THEREOF AS PROTEIN KINASE INHIBITOR 科辉智药生物科技(无锡)有限公司 2024-03-28 WO disclosed
CN-117736198-A Macrocyclic nitrogen crown ether compounds and their use as protein kinase inhibitors 科辉智药生物科技(深圳)有限公司 2024-03-22 CN disclosed
US-20230192701-A1 BICYCLIC KINASE INHIBITORS AND USES THEREOF IOMX THERAPEUTICS AG (DE) 2023-06-22 US disclosed
US-20220162163-A1 ALANINE-BASED MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2022-05-26 US disclosed
US-20220162163-A1 ALANINE-BASED MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2022-05-26 US disclosed
US-20170037004-A1 ALANINE-BASED MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2017-02-09 US disclosed
US-20170037004-A1 ALANINE-BASED MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2017-02-09 US disclosed
US-20170037004-A1 ALANINE-BASED MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2017-02-09 US disclosed
EP-2593461-B1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BRISTOL MYERS SQUIBB CO (US) 2016-08-17 EP disclosed
US-20120184565-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BRISTOL-MYERS SQUIBB COMPANY 2012-07-19 US disclosed
US-20120184565-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BRISTOL-MYERS SQUIBB COMPANY 2012-07-19 US disclosed
WO-2012009309-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2012-01-19 WO disclosed
WO-2012009309-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2012-01-19 WO disclosed
CN-1021824-C herbicidal active compositions containing substituted benzofurans SHELL INT RESEARCH (NL) 1993-08-18 CN disclosed
US-5053071-A For cereal crops E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-10-01 US disclosed
US-4948418-A PREEMERGENCE AND POSTEMERGENCE HERBICIDES; WEED CONTROL, RICE, WHEAT, BARLEY, CORN, SOYBEANS, BEETS AND COTTON E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-08-14 US disclosed
US-4881967-A Heterocyclic 2,3-dihydrobenzofuran herbicides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-11-21 US disclosed
CN-87107276-A Substituted benzofurans and benzopyrans having herbicidal activity 1988-10-19 CN disclosed
EP-0271170-A2 Herbicidal substituted benzofurans and benzopyrans SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1988-06-15 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 (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-20120184565-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION APP, BACE1, IAPP HSD17B10 1356/4885PDE7A 865/4885VCAM1 3281/4885
US-20220162163-A1 ALANINE-BASED MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE XIAP, BIRC3, BIRC2 HSD17B10 2495/4885PDE7A 2933/4885VCAM1 2926/4885
US-20230192701-A1 BICYCLIC KINASE INHIBITORS AND USES THEREOF MITF, PRKDC, PRKACA HSD17B10 3482/4885PDE7A 2255/4885VCAM1 3154/4885
US-20170037004-A1 ALANINE-BASED MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE XIAP, BIRC3, BIRC2 HSD17B10 2495/4885PDE7A 2933/4885VCAM1 2926/4885

“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.