SCHEMBL3206919

SCHEMBL3206919

N#CC1(c2cccc(Br)c2)CC1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.45
WDR5 P61964 4/20 0.44
OPRM1 P35372 3/20 0.40
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
OPRL1 P41146 2/20 0.36

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
SCHEMBL17632371 0.93 WDR5 (0.46) KMT2AWDR5OPRM1
SCHEMBL1492681 0.93 WDR5 (0.46) KMT2AWDR5OPRM1CA12CA1
SCHEMBL3171333 0.91 WDR5 (0.47) KMT2AWDR5OPRM1
SCHEMBL332840 0.88 KMT2A (0.40) KMT2AWDR5OPRM1OPRL1
SCHEMBL4442862 0.88 KMT2A (0.40) KMT2AWDR5OPRM1CA12CA1
Hydrochloric Acid SCHEMBL29237533 0.87 KMT2A (0.40) KMT2AWDR5OPRM1CA12CA1
SCHEMBL2290005 0.87 PDE4A (0.44) KMT2AWDR5OPRM1
Hydrochloric Acid SCHEMBL30217436 0.87 KMT2A (0.40) KMT2AWDR5OPRM1CA12CA1
SCHEMBL30520809 0.86 KMT2A (0.38) KMT2AWDR5OPRM1
SCHEMBL3016883 0.84 CA12 (0.43) KMT2AWDR5OPRM1CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4859232-A Substituted-aryl cyclopropanecarbonitriles and derivatives thereof as herbicide antidotes MONSANTO COMPANY (US) 1989-08-22 US claimed
EP-4720037-A1 CYP26B1 INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF 16380026 Canada Inc. (CA) 2026-04-08 EP disclosed
EP-4720036-A1 CYP26B1 INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF 16380026 Canada Inc. (CA) 2026-04-08 EP disclosed
US-20250230147-A1 LACTAMS AS CBL-B INHIBITORS GENENTECH, INC. (US) 2025-07-17 US disclosed
US-20250120944-A1 ANTIBACTERIAL COMPOSITION SEOUL NATIONAL UNIVERSITY R&DB FOUNDATION (KR) 2025-04-17 US disclosed
WO-2024243692-A1 CYP26B1 INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF QUEEN'S UNIVERSITY AT KINGSTON (CA) 2024-12-05 WO disclosed
US-20240300927-A1 AMIDES AS CBL-B INHIBITORS GENENTECH, INC. (US) 2024-09-12 US disclosed
EP-4410774-A1 ANTIBACTERIAL COMPOSITION Seoul National University R&DB Foundation (KR) 2024-08-07 EP disclosed
EP-3577099-B1 A NOVEL PROCESS FOR THE SYNTHESIS OF 1-ARYL-1-TRIFLUOROMETHYLCYCLOPROPANES IDORSIA PHARMACEUTICALS LTD (CH) 2024-01-24 EP disclosed
EP-4288428-A1 AMIDES AS CBL-B INHIBITORS Genentech, Inc. (US) 2023-12-13 EP disclosed
US-20070213316-A1 Compounds that are effective inhibitors of beta-secretase; inhibitors of beta-secretase-mediated cleavage of amyloid precursor proteins; effective inhibitors of A beta production, and/or are effective to reduce amyloid beta deposits or plaques; treatment of disorders such as Alzheimer's Disease ELAN PHARMACEUTICALS, INC. 2007-09-13 US disclosed
EP-1673336-A4 CATHEPSIN CYSTEINE PROTEASE INHIBITORS MERCK FROSST CANADA LTD (CA) 2007-05-30 EP disclosed
US-20070105921-A1 Process for Preparing Oxazole Intermediates PHARMACIA & UPJOHN COMPANY 2007-05-10 US disclosed
US-7176242-B2 N,N′-substituted-1,3-diamino-2-hydroxypropane derivatives ELAN PHARMACEUTICALS, INC. (US) 2007-02-13 US disclosed
US-20060287373-A1 Cathepsin cysteine protease inhibitors MERCK CANADA INC. (CA) 2006-12-21 US disclosed
EP-1673336-A1 CATHEPSIN CYSTEINE PROTEASE INHIBITORS Merck Frosst Canada Ltd. (CA) 2006-06-28 EP disclosed
US-20050065346-A1 Carboxylic acid amides, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA KG (DE) 2005-03-24 US disclosed
WO-2005019161-A1 CATHEPSIN CYSTEINE PROTEASE INHIBITORS MERCK FROSST CANADA LTD. (CA) 2005-03-03 WO disclosed
EP-1206446-B1 CARBOXYLIC ACID AMIDES, THEIR PRODUCTION AND THEIR USE AS DRUGS BOEHRINGER INGELHEIM PHARMA (DE) 2004-05-26 EP disclosed
US-4859232-A Substituted-aryl cyclopropanecarbonitriles and derivatives thereof as herbicide antidotes MONSANTO COMPANY (US) 1989-08-22 US 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-20250120944-A1 ANTIBACTERIAL COMPOSITION SQSTM1, BECN1, ATG7 KMT2A 3655/4885WDR5 139/4885OPRM1 1599/4885
US-20240300927-A1 AMIDES AS CBL-B INHIBITORS CBLB, CBL, CBLC KMT2A 526/4885WDR5 611/4885OPRM1 3983/4885
US-20250230147-A1 LACTAMS AS CBL-B INHIBITORS CBLB, CBL, CBLC KMT2A 1976/4885WDR5 450/4885OPRM1 3955/4885
US-20050065346-A1 Carboxylic acid amides, the preparation thereof and their use as pharmaceutical compositions F12, F11, F2 KMT2A 3156/4885WDR5 4299/4885OPRM1 206/4885
US-20070213316-A1 Compounds that are effective inhibitors of beta-secretase; inhibitors of beta-secretase-mediated cleavage of amyloid precursor proteins; effective inhibitors of A beta production, and/or are effective to reduce amyloid beta deposits or plaques; treatment of disorders such as Alzheimer's Disease BACE1, BACE2, APP KMT2A 4650/4885WDR5 3150/4885OPRM1 4080/4885
US-20060287373-A1 Cathepsin cysteine protease inhibitors CTSE, CTSS, CTSB KMT2A 4202/4885WDR5 4274/4885OPRM1 4398/4885
US-20070105921-A1 Process for Preparing Oxazole Intermediates OXA1L, SOD1, PSEN1 KMT2A 2600/4885WDR5 1759/4885OPRM1 857/4885

“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.