SCHEMBL755089

SCHEMBL755089

C[C@H]1C[C@]2(CCN1CC1CCC1)C(NC1CCCCC1)=NC(=O)N2c1cccc(Br)c1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.35
HPGD P15428 1/20 0.35
RORC P51449 1/20 0.34
OPRD1 P41143 5/20 0.32
OPRM1 P35372 4/20 0.32
OPRK1 P41145 4/20 0.32
OPRL1 P41146 2/20 0.32
MEN1 O00255 1/20 0.32
ADORA3 P0DMS8 2/20 0.31
ADORA1 P30542 2/20 0.31
HSP90AA1 P07900 1/20 0.30
MAPT P10636 1/20 0.30
THRB P10828 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL4740733 1.00 KMT2A (0.35) KMT2AHPGDRORCOPRD1OPRM1
Hydrochloric Acid SCHEMBL5616268 0.99 KMT2A (0.34) KMT2AHPGDRORCOPRD1OPRM1
Hydrochloric Acid SCHEMBL757174 0.99 KMT2A (0.34) KMT2AHPGDRORCOPRD1OPRM1
SCHEMBL757090 0.91 MAPT (0.36) KMT2AHPGDOPRD1OPRM1OPRK1
SCHEMBL757580 0.91 MAPT (0.36) KMT2AHPGDOPRD1OPRM1OPRK1
Hydrochloric Acid SCHEMBL755877 0.90 MAPT (0.35) KMT2AHPGDOPRD1OPRM1OPRK1
SCHEMBL764691 0.89 ADORA3 (0.40) OPRD1OPRM1OPRK1OPRL1ADORA3
SCHEMBL755429 0.80 BACE1 (0.34) OPRD1OPRM1OPRL1ADORA3ADORA1
SCHEMBL760030 0.80 BACE1 (0.34) OPRD1OPRM1OPRL1ADORA3ADORA1
SCHEMBL755862 0.80 BACE1 (0.34) OPRD1OPRM1OPRL1ADORA3ADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3723533-B1 ATHLETIC SHOE WITH A SHELL INSERTED BETWEEN THE UPPER AND A COMFORT SOLE NORTH FACE APPAREL CORP (US) 2024-07-17 EP claimed
EP-4103802-B1 GLASS DOOR WITH A HANDLE ASSEMBLY REHAU BEHR AS (DK) 2024-03-27 EP claimed
EP-3469419-B1 INTEGRATION OF ELECTROCHROMIC FILMS ON A SUBSTRATE FURCIFER INC (US) 2023-11-29 EP claimed
EP-3873545-B1 MULTI-LAYER BAG WITH LOSS OF INTEGRITY MEANS OF DETECTION BECTON DICKINSON FRANCE (FR) 2023-11-29 EP claimed
EP-3281626-B1 SOLUBLE MICRONEEDLE FOR DELIVERING POORLY-SOLUBLE DRUG LG HOUSEHOLD & HEALTH CARE LTD (KR) 2023-08-23 EP claimed
EP-3956390-B1 METHOD FOR SURFACE FUNCTIONALISATION IN A SUPERCRITICAL FLUID MEDIUM COMMISSARIAT ENERGIE ATOMIQUE (FR) 2023-08-09 EP claimed
EP-3522825-B1 IMPLANTABLE DEVICES FOR DRUG DELIVERY WITH REDUCED BURST RELEASE TITAN PHARMACEUTICALS INC (US) 2023-06-07 EP claimed
EP-3801100-B1 METHODS FOR FORMING FOOTWEAR USING RECYCLED PLASTICS NIKE INNOVATE CV (US) 2023-02-22 EP claimed
EP-3720914-B1 AQUEOUS COATING COMPOSITIONS FOR FORMING ANTI-GRAIN-PUFFING COATINGS ON WOOD SUBSTRATE, AQUEOUS PAINTS AND ARTICLES GUANGDONG HUARUN PAINTS CO LTD (CN) 2023-02-01 EP claimed
EP-3001478-B1 ENCAPSULATION FILM AND METHOD FOR ENCAPSULATING ORGANIC ELECTRONIC DEVICE USING SAME LG CHEMICAL LTD (KR) 2023-01-18 EP claimed
WO-2007147811-A2 METHOD FOR PRODUCING THIN LAYERS OF A SILICON, AND THIN SILICON HUHTAMAKI FORCHHEIM ZWEIGNIEDERLASSUNG DER HUHTAMAKI DEUTSCHLAND GMBH & CO KG (DE) 2007-12-27 WO claimed
EP-1668088-B1 ADHESIVE ARTICLES COMPRISING A NANOPARTICLE PRIMER AND METHODS FOR PREPARING SAME 3M INNOVATIVE PROPERTIES CO (US) 2007-10-31 EP claimed
US-20070021454-A1 Spiropiperidine beta-secretase inhibitors for the treatment of Alzheimer's disease MERCK SHARP & DOHME LLC 2007-01-25 US claimed
WO-2007011833-A2 SPIROPIPERIDINE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE MERCK & CO., INC. (US) 2007-01-25 WO claimed
WO-2007011810-A1 SPIROPIPERIDINE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE MERCK & CO., INC. (US) 2007-01-25 WO claimed
EP-1661686-A2 Method of manufacturing a thin layer of silicone, thin silicone layer and application Huhtamaki Forchheim Zweigniederlassung der Huhtamaki Deutschland GmbH & Co. KG (DE) 2006-05-31 EP claimed
EP-1178925-B1 BALLISTIC RESISTANT PANEL AND METHOD OF MAKING SURVIVAL INC (US) 2004-11-10 EP claimed
EP-1018423-B1 Tough heat shrinkable film structures AMERICAN NAT CAN CO (US) 2003-05-28 EP claimed
EP-0567125-B1 Pre-cooked food product package VISKASE CORP (US) 1996-10-23 EP claimed
EP-0141108-B1 PLASTICS SHEET BASED ON VINYL CHLORIDE HOMOPOLYMERS AND/OR COPOLYMERS J. H. Benecke AG (DE) 1989-04-05 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20070021454-A1 Spiropiperidine beta-secretase inhibitors for the treatment of Alzheimer's disease BACE1, APP, PSEN1 KMT2A 4150/4885HPGD 825/4885RORC 813/4885

“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.