SCHEMBL99646

SCHEMBL99646

C=CCNc1ccc(NCC=C)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.65
CA1 P00915 1/20 0.65
CA2 P00918 1/20 0.65
CA9 Q16790 1/20 0.65
RRM2 P31350 1/20 0.40
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
KDM4E B2RXH2 3/20 0.38
GAA P10253 2/20 0.38
HPGD P15428 2/20 0.38
HTT P42858 2/20 0.38
MAPT P10636 2/20 0.38
RAB9A P51151 1/20 0.38
MITF O75030 1/20 0.38
NSD2 O96028 1/20 0.38
LMNA P02545 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38

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
SCHEMBL1585896 0.92 CA12 (0.59) CA12CA1CA2CA9RRM2
Water SCHEMBL11215220 0.90 CA12 (0.57) CA12CA1CA2CA9RRM2
SCHEMBL6029585 0.88 CA12 (0.55) CA12CA1CA2CA9RRM2
SCHEMBL2281904 0.88 CA12 (0.55) CA12CA1CA2CA9RRM2
SCHEMBL6003024 0.88 CA12 (0.55) CA12CA1CA2CA9RRM2
SCHEMBL3395424 0.88 CA12 (0.55) CA12CA1CA2CA9RRM2
SCHEMBL174596 0.88 CA1 (0.55) CA12CA1CA2CA9RRM2
SCHEMBL7717454 0.88 CA1 (0.55) CA12CA1CA2CA9RRM2
SCHEMBL4243384 0.88 CA12 (0.55) CA12CA1CA2CA9KMT2A
SCHEMBL170694 0.88 MAPT (0.56) CA12CA1CA2CA9KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4365163-A1 METHOD FOR PRODUCING N,N`-DIALKYL-P-PHENYLENEDIAMINE LANXESS Deutschland GmbH (DE) 2024-05-08 EP claimed
EP-3514200-B1 A METHOD OF DEVULCANIZING A RUBBER VULCANIZATE KARGRO RECYCLING B V (NL) 2020-08-26 EP claimed
EP-3197596-B1 METHOD FOR IMPROVED REACTIVE MONOMER PRODUCTION WITH MEMBRANE FILTRATION EVONIK DEGUSSA GMBH (DE) 2018-11-07 EP claimed
US-20180134879-A1 INFLATABLE STOPPER J. VAN BEUGEN BEHEER B,V, (NL) 2018-05-17 US claimed
EP-3315549-A1 INFLATABLE STOPPER J. van Beugen Beheer B.V. (NL) 2018-05-02 EP claimed
EP-2993164-B1 Phenolic (thio) acetals as inhibitors of the polymerisation of olefinically unsaturated monomers EVONIK DEGUSSA GMBH (DE) 2017-02-15 EP claimed
US-20150307466-A1 PROCESS FOR THE DISTILLATION OF A MIXTURE COMPRISING A CYCLIC N-VINYLAMIDE BASF SE (DE) 2015-10-29 US claimed
US-20120248378-A1 Substituted Triazine Compositions and Methods for Producing Same ADDIVANT USA, LLC 2012-10-04 US claimed
JP-2011527715-A 2011-11-04 JP claimed
EP-2297241-B1 SUBSTITUTED TRIAZINE COMPOSITIONS AND METHODS FOR PRODUCING SAME CHEMTURA CORP (US) 2011-10-26 EP claimed
US-5536427-A SECONDARY AMINE ADDITIVE SODICK CO., LTD. (JP) 1996-07-16 US claimed
EP-0677072-A1 ROOM TEMPERATURE CURABLE SILANE-TERMINATED POLYURETHANE DISPERSIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-10-18 EP claimed
WO-1994013723-A1 ROOM TEMPERATURE CURABLE SILANE-TERMINATED POLYURETHANE DISPERSIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-06-23 WO claimed
EP-0538694-A2 Polyurea or polyurea-urethane adhesive for bonding elastomers H.B. FULLER LICENSING & FINANCING, INC. (US) 1993-04-28 EP claimed
US-5183877-A For retread tires H. B. FULLER COMPANY (US) 1993-02-02 US claimed
US-4960620-A PATCHING PAVEMENT USING A MIXTURE OF ISOCYANATE-POLYOL PREPOLYMER, AN AROMATIC N,N'-ALKYL DIAMINE CURING AGENT, A FATTY ACID AND AN ORGANOMETALLIC CATALYST UOP (US) 1990-10-02 US claimed
US-4874831-A Room-temperature-cured polyurethanes and polyureas UOP (US) 1989-10-17 US claimed
US-4690786-A Process for producing a microcapsule containing a liquid active material NITTO ELECTRIC INDUSTRIAL CO., LTD. (JP) 1987-09-01 US claimed
US-4647328-A Process for making belted tires free of undertread cements THE UNIROYAL GOODRICH TIRE COMPANY (US) 1987-03-03 US claimed
US-4334044-A AMINO OR IMINO GROUP REACTIVE IN THE PRESSENCE OF AN ACID-CATALYST JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1982-06-08 US claimed