SCHEMBL9423375

SCHEMBL9423375

CCCCCC/C=C(/C#N)CBr

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.41
FAAH O00519 4/20 0.41
TSHR P16473 2/20 0.35
TERT O14746 3/20 0.32
PTPN1 P18031 3/20 0.32
CYP1A2 P05177 2/20 0.32
MAPT P10636 2/20 0.32
CYP2C19 P33261 2/20 0.32
BLM P54132 2/20 0.32
HSD17B10 Q99714 2/20 0.32
FABP4 P15090 2/20 0.32
PPARG P37231 2/20 0.32
KMT2A Q03164 2/20 0.32
PPARD Q03181 2/20 0.32
PPARA Q07869 2/20 0.32
GMNN O75496 1/20 0.32
USP2 O75604 1/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
CYP2C9 P11712 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
SCHEMBL9423377 1.00 EP300 (0.41) EP300FAAHTSHRTERTPTPN1
SCHEMBL14809301 0.84 EP300 (0.44) EP300FAAHTSHRTERTPTPN1
SCHEMBL14809302 0.84 EP300 (0.44) EP300FAAHTSHRTERTPTPN1
SCHEMBL9540427 0.82 EP300 (0.42) EP300FAAHTERTPTPN1CYP1A2
SCHEMBL29190453 0.82 EP300 (0.42) EP300FAAHTSHRTERTPTPN1
SCHEMBL9540432 0.82 EP300 (0.42) EP300FAAHTERTPTPN1CYP1A2
SCHEMBL29190464 0.82 EP300 (0.41) EP300FAAHTSHRTERTPTPN1
SCHEMBL761752 0.80 EP300 (0.39) EP300FAAHTERTPTPN1CYP1A2
SCHEMBL29190454 0.80 EP300 (0.39) EP300FAAHTERTPTPN1CYP1A2
SCHEMBL761753 0.80 EP300 (0.39) EP300FAAHTERTPTPN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5354777-A Cyanoalkene derivatives, process for their preparation, and their use as microbicide for the protection of materials BAYER AKTIENGESELLSCHAFT (DE) 1994-10-11 US disclosed
EP-0559002-A1 Cyanoalkene derivatives, method for their preparation and their use as microbiocides for protecting materials BAYER AG (DE) 1993-09-08 EP disclosed