SCHEMBL42764

SCHEMBL42764

C/C=[C]/C1=CCCCCC1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.36
GRM5 P41594 2/20 0.36
FFAR1 O14842 1/20 0.32

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
SCHEMBL6587737 0.98
SCHEMBL6589758 0.91
SCHEMBL6590306 0.75 CYP1A2 (0.34) CYP1A2GRM5FFAR1
SCHEMBL8197417 0.70 CYP1A2 (0.39) CYP1A2GRM5FFAR1
SCHEMBL2193339 0.70
SCHEMBL19280743 0.70 CYP1A2 (0.39) CYP1A2GRM5FFAR1
SCHEMBL8197420 0.70 CYP1A2 (0.39) CYP1A2GRM5FFAR1
SCHEMBL10457078 0.70 CYP1A2 (0.39) CYP1A2GRM5FFAR1
SCHEMBL150206 0.70
SCHEMBL18828533 0.70 CYP1A2 (0.39) CYP1A2GRM5FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240117117-A1 CARBOHYDRATE POLYAMINE BINDERS AND MATERIALS MADE THEREWITH KNAUF INSULATION SPRL (BE) 2024-04-11 US disclosed
US-20240115553-A1 COMPOSITIONS AND METHODS FOR TREATING BRAIN INJURY AZEVAN PHARMACEUTICALS, INC. (US) 2024-04-11 US disclosed
WO-2024064209-A1 COMPOSITIONS AND METHODS FOR TREATING MYCOBACTERIUM INFECTIONS DATA2DISCOVERY, INC. (US) 2024-03-28 WO disclosed
WO-2024039864-A1 PROTEIN:PROTEIN INTERACTION INHIBITORS PURDUE RESEARCH FOUNDATION (US) 2024-02-22 WO disclosed
EP-4324882-A2 BINDERS Knauf Insulation SPRL (BE) 2024-02-21 EP disclosed
US-20240034918-A1 BINDERS AND ASSOCIATED PRODUCTS KNAUF INSULATION SPRL (BE) 2024-02-01 US disclosed
EP-3146010-B1 BINDERS KNAUF INSULATION INC (US) 2023-12-13 EP disclosed
US-11814481-B2 Carbohydrate polyamine binders and materials made therewith KNAUF INSULATION, INC. (US) 2023-11-14 US disclosed
WO-2023215238-A1 PREPARATION AND USES OF 7-AZAINDENOISOQUINOLINES PURDUE RESEARCH FOUNDATION (US) 2023-11-09 WO disclosed
EP-4245762-A2 BINDERS AND ASSOCIATED PRODUCTS Knauf Insulation SPRL (BE) 2023-09-20 EP disclosed
WO-2012019123-A1 PROCESSES FOR PREPARING TUBULYSINS ENDOCYTE, INC. (US) 2012-02-09 WO disclosed
WO-2012003436-A1 METHODS FOR TREATING POST TRAUMATIC STRESS DISORDER AZEVAN PHARMACEUTICALS, INC. (US) 2012-01-05 WO disclosed
WO-2011138459-A1 CARBOHYDRATE BINDERS AND MATERIALS MADE THEREWITH KNAUF INSULATION (BE) 2011-11-10 WO disclosed
WO-2011138458-A1 CARBOHYDRATE POLYAMINE BINDERS AND MATERIALS MADE THEREWITH KNAUF INSULATION (BE) 2011-11-10 WO disclosed
WO-2011112864-A1 PARENTERAL FORMULATIONS OF MACROLIDE ANTIBIOTICS CEMPRA PHARMACEUTICALS, INC. (US) 2011-09-15 WO disclosed
WO-2011109232-A1 COMPOSITIONS AND METHODS FOR TREATING VIRAL DISEASES NOVADRUG, LLC (US) 2011-09-09 WO disclosed
WO-2011094416-A1 SUBSTITUTED NORINDENOISOQUINOLINES, SYNTHESES THEREOF, AND METHODS OF USE PURDUE RESEARCH FOUNDATION (US) 2011-08-04 WO disclosed
WO-2011085185-A1 SOLUBLE GRAPHENE NANOSTRUCTURES AND ASSEMBLIES THEREFROM LI LIANG-SHI (US) 2011-07-14 WO disclosed
WO-2011032052-A1 METHODS FOR TREATING MALARIA, TUBERCULOSIS AND MAC DISEASES CEMPRA PHARMACEUTICALS, INC. (US) 2011-03-17 WO disclosed
WO-2010132494-A1 COMPOUNDS AND METHODS FOR TREATING AIDS AND HIV INFECTIONS GHOSH ARUN K (US) 2010-11-18 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 (2 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-20240115553-A1 COMPOSITIONS AND METHODS FOR TREATING BRAIN INJURY FABP7, PYGB, CHAT CYP1A2 2732/4885GRM5 536/4885FFAR1 4586/4885
US-20240034918-A1 BINDERS AND ASSOCIATED PRODUCTS VCL, C1QBP, TBCB CYP1A2 4032/4885GRM5 3069/4885FFAR1 4528/4885

“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.