SCHEMBL319448

SCHEMBL319448

CCCCNC(=O)CC#N

nearest known ligand 0.77

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 4/20 0.77
ALDH1A1 P00352 1/20 0.49
GAA P10253 1/20 0.49
CASP2 P42575 1/20 0.48
EPHX1 P07099 4/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
NAAA Q02083 1/20 0.46
ACHE P22303 1/20 0.44
MMP2 P08253 1/20 0.44
HPGD P15428 1/20 0.43
FAAH O00519 2/20 0.43
CNR1 P21554 1/20 0.42
MGLL Q99685 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
SCHEMBL6317039 0.94 MCL1 (0.74) MCL1ALDH1A1GAACASP2EPHX1
SCHEMBL1961539 0.92 MCL1 (0.71) MCL1CASP2EPHX1MEN1KMT2A
SCHEMBL1958608 0.92 MCL1 (0.71) MCL1CASP2EPHX1MEN1KMT2A
SCHEMBL1960367 0.92 MCL1 (0.71) MCL1CASP2EPHX1MEN1KMT2A
SCHEMBL1962964 0.92 MCL1 (0.71) MCL1CASP2EPHX1MEN1KMT2A
SCHEMBL6320829 0.92 MCL1 (0.71) MCL1CASP2EPHX1MEN1KMT2A
SCHEMBL1962966 0.92 MCL1 (0.71) MCL1CASP2EPHX1MEN1KMT2A
SCHEMBL1962363 0.92 MCL1 (0.71) MCL1CASP2EPHX1MEN1KMT2A
SCHEMBL1961150 0.92 MCL1 (0.71) MCL1CASP2EPHX1MEN1KMT2A
SCHEMBL3394896 0.92 MCL1 (0.71) MCL1CASP2EPHX1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113956420-B Polyurethane yoga mat and preparation method thereof 南通恒嘉家居科技有限公司 2023-04-18 CN claimed
CN-113956420-A Polyurethane yoga mat and preparation method thereof 南通恒嘉家居科技有限公司 2022-01-21 CN claimed
US-10059823-B2 Additives for improving polyurethane foam performance EVONIK DEGUSSA GMBH (DE) 2018-08-28 US claimed
EP-2729510-B1 PROCESS FOR PRODUCING FLEXIBLE POLYURETHANE FOAM USING NATURAL OIL POLYOLS AIR PROD & CHEM (US) 2016-11-16 EP claimed
US-20160002426-A1 Additives for Improving Polyurethane Foam Performance AIR PRODUCTS AND CHEMICALS, INC. (US) 2016-01-07 US claimed
EP-2591031-B1 PROCESS FOR PRODUCING FLEXIBLE POLYURETHANE FOAM AIR PROD & CHEM (US) 2015-06-17 EP claimed
EP-2738192-B1 Process for producing flexible polyurethane foam AIR PROD & CHEM (US) 2015-06-10 EP claimed
EP-2738192-A1 Process for producing flexible polyurethane foam AIR PRODUCTS AND CHEMICALS, INC. (US) 2014-06-04 EP claimed
EP-3494154-B1 POLYURETHANE FOAM FOR THIN WALL APPLICATIONS DOW GLOBAL TECHNOLOGIES LLC (US) 2023-11-22 EP disclosed
CN-113956420-B Polyurethane yoga mat and preparation method thereof 南通恒嘉家居科技有限公司 2023-04-18 CN disclosed
WO-2023031246-A1 SUBSTITUTED THIOPHENE COMPOUNDS AS D-DOPACHROME TAUTOMERASE INHIBITORS RIJKSUNIVERSITEIT GRONINGEN (NL) 2023-03-09 WO disclosed
CN-109563227-B Polyurethane foams for thin-walled applications 陶氏环球技术有限责任公司 2022-08-26 CN disclosed
CN-113956420-A Polyurethane yoga mat and preparation method thereof 南通恒嘉家居科技有限公司 2022-01-21 CN disclosed
CN-113801187-A Preparation and application of Michael acceptor type main protease inhibitor targeting novel coronavirus 南开大学 2021-12-17 CN disclosed
US-3991054-A FOR POLYESTERS BASF AKTIENGESELLSCHAFT (DT) 1976-11-09 US disclosed
US-3985763-A DYESTUFFS BAYER AKTIENGESELLSCHAFT (DT) 1976-10-12 US disclosed
US-3978077-A DIURETIC, HYPOTENSIVE, ANTITHROMBOTIC BAYER AKTIENGESELLSCHAFT (GB) 1976-08-31 US disclosed
US-3957814-A DIURETICS, SALURETICS, HYPOTENSIVE AGENTS, ANTITHROMBOTIC BAYER AKTIENGESELLSCHAFT (DT) 1976-05-18 US disclosed
US-3952008-A DIURETIC, SALURETIC, HYPOTENSIVE, ANTITHROMBOTIC BAYER AKTIENGESELLSCHAFT (DT) 1976-04-20 US disclosed
US-3950528-A HYPOTENSIVE AGENTS, SALURETICS, DIURETICS BAYER AKTIENGESELLSCHAFT (DT) 1976-04-13 US disclosed