SCHEMBL10779683

SCHEMBL10779683

CCCC(C)=C(C#N)C#N

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.32
CES2 O00748 1/20 0.30
CES1 P23141 1/20 0.30

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
SCHEMBL15865545 0.77
SCHEMBL21378222 0.74 CES2 (0.32) CES2CES1
SCHEMBL4932825 0.72 FFAR3 (0.35) CES2CES1
SCHEMBL31607321 0.71 CES1 (0.44) TDP1CES2CES1
SCHEMBL7982862 0.71
SCHEMBL27371445 0.70
SCHEMBL7158021 0.70 KMT2A (0.44)
SCHEMBL11764053 0.70 TSHR (0.38)
SCHEMBL10298555 0.70 KMT2A (0.50)
SCHEMBL6263184 0.69 HDAC3 (0.39) CES2CES1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3397637-B1 COMPOUND FOR PHOTOACTIVE ORGANIC ELECTRONIC ELEMENT, AND PHOTOACTIVE ORGANIC ELECTRONIC ELEMENT COMPRISING THE COMPOUND HELIATEK GMBH (DE) 2021-08-11 EP disclosed
WO-2017114937-A1 COMPOUND FOR PHOTOACTIVE ORGANIC ELECTRONIC COMPONENTS AND PHOTOACTIVE ORGANIC ELECTRONIC COMPONENT CONTAINING THE COMPOUND HELIATEK GMBH (DE) 2017-07-06 WO disclosed
US-4684751-A HYDRATION OF NITRILES AND ALKENES, PHASE TRANSFER AGENT THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1987-08-04 US disclosed
US-4134981-A ANTIALLERGENS PFIZER INC. (US) 1979-01-16 US disclosed
US-4120962-A Fused pyrimidin-4(3H)-ones as antiallergy agents PFIZER INC. (US) 1978-10-17 US disclosed
US-4044134-A FUSED WITH QUINOLINE OR PYRIDINE, 2-METHYL, ETHYL, OR ACETYL GROUP PFIZER INC. (US) 1977-08-23 US disclosed
US-3974161-A Fused pyrimidin-4(3H)-ones as antiallergy agents PFIZER INC. (US) 1976-08-10 US disclosed
US-3962264-A AMMONIA, TETRA-ALKOXY-PROPANE, MALONONITRILE PFIZER INC. (US) 1976-06-08 US disclosed
US-3950160-A INHIBITING THE GROWTH OF WEEDS WITH 2-SUBSTITUTED PYRDIDOPYIMIDINES AND SALTS THEREOF PFIZER INC. (US) 1976-04-13 US disclosed