SCHEMBL251559

SCHEMBL251559

C=CC[C]1CCCC1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL7741625 0.97 NOS3 (0.33)
SCHEMBL251858 0.97
SCHEMBL7740958 0.97 NOS3 (0.33)
SCHEMBL4652588 0.97 NOS3 (0.33)
SCHEMBL7739726 0.97 NOS3 (0.33)
SCHEMBL1080498 0.94
SCHEMBL432350 0.87
SCHEMBL2696185 0.75 CYP3A4 (0.31)
SCHEMBL7741524 0.71
SCHEMBL7733038 0.69 NOS3 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210309620-A1 COMPOSITIONS AND METHODS FOR TREATING AND/OR PREVENTING CELL OR TISSUE NECROSIS SPECIFICALLY TARGETING CATHEPSIN C AND/OR CELA1 AND/OR CELA3A AND/OR STRUCTURALLY RELATED ENZYMES THERETO Ela Pharma Ltd (IL) 2021-10-07 US claimed
US-20190298690-A1 DRY POWDER INHALER COMPOSITIONS OF 7-AZONIABICYCLO[2.2.1]HEPTANE DERIVATIVES THERON PHARMACEUTICALS, INC. 2019-10-03 US claimed
EP-3400214-A1 DRY POWDER INHALER COMPOSITIONS OF 7-AZONIABICYCLO[2.2.1]HEPTANE DERIVATIVES Theron Pharmaceuticals, Inc. (US) 2018-11-14 EP claimed
US-20180312477-A1 COMPOSITIONS FOR TREATING AND/OR PREVENTING CELL OR TISSUE NECROSIS SPECIFICALLY TARGETING CATHEPSIN C AND/OR CELA1 AND/OR CELA3A AND/OR STRUCTURALLY RELATED ENZYMES THERETO Ela Pharma Ltd (IL) 2018-11-01 US claimed
EP-3280401-A1 COMPOSITIONS FOR TREATING AND/OR PREVENTING CELL OR TISSUE NECROSIS SPECIFICALLY TARGETING CATHEPSIN C AND/OR CELA1 AND/OR CELA3A AND/OR STRUCTURALLY RELATED ENZYMES THERETO ELA Pharma Ltd (IL) 2018-02-14 EP claimed
CN-107690429-A composition for the treatment and/or prevention of cell or tissue necrosis, specifically targeting cathepsin C and/or CE L a1 and/or CE L A3A and/or enzymes structurally related thereto ELA制药有限公司 2018-02-13 CN claimed
EP-2383299-B1 SOLID PARTICULATE CATALYSTS COMPRISING BRIDGED METALLOCENES BOREALIS AG (AT) 2017-12-20 EP claimed
EP-2528921-B1 7-AZONIABICYCLO [2.2.1]HEPTANE DERIVATIVES, METHODS OF PRODUCTION, AND PHARMACEUTICAL USES THEREOF THERON PHARMACEUTICALS INC (US) 2017-10-18 EP claimed
US-9708349-B2 Borates for photoactivated chemical bleaching GENERAL ELECTRIC COMPANY (US) 2017-07-18 US claimed
WO-2017120559-A1 DRY POWDER INHALER COMPOSITIONS OF 7-AZONIABICYCLO[2.2.1]HEPTANE DERIVATIVES THERON PHARMACEUTICALS, INC. (US) 2017-07-13 WO claimed
US-5545781-A CONDUCTING REACTION IN PRESENCE OF LIME AND PRIMARY AMINE ENICHEM ELASTOMERES FRANCE S.A. (FR) 1996-08-13 US claimed
EP-0714299-A4 1996-07-10 EP claimed
EP-0714299-A1 BENZOXAZINONE AND BENZOPYRIMIDINONE PIPERIDINYL TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS MERCK & CO. INC. (US) 1996-06-05 EP claimed
US-5434034-A Silver halide color photography process with cyan dyes on supports for development FUJI PHOTO FILM CO., LTD. (JP) 1995-07-18 US claimed
EP-0644171-A1 Process for dehydrochlorinating 3,4-dichloro-1-butene to yield chloroprene ENICHEM ELASTOMERES FRANCE SA (FR) 1995-03-22 EP claimed
WO-1995002405-A1 BENZOXAZINONE AND BENZOPYRIMIDINONE PIPERIDINYL TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1995-01-26 WO claimed
US-4923993-A Process for the preparation of 2-pyridinecarboxylic acid derivatives and 1-amino-1,4-dihydropyridine-2-carboxylic acid derivatives CIBA-GEIGY CORPORATION (US) 1990-05-08 US claimed
US-4883877-A CALCIUM METABOLISM REGULATORS, INHIBIT BONE RESORPTION, ANTIARTHRITIC CIBA-GEIGY CORPORATION (US) 1989-11-28 US claimed
US-4093625-A 6-Sulfur analogs of penicillins and cephalosporins MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1978-06-06 US claimed
US-3932503-A Benzenesulfonyl ureas HOECHST AKTIENGESELLSCHAFT (DT) 1976-01-13 US claimed