SCHEMBL7565080

SCHEMBL7565080

N#Cc1c(C=CC(=O)NCCCCCCNC(=O)C=Cc2cccc(-c3ccccc3)c2C#N)cccc1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.48
LMNA P02545 2/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
EGFR P00533 1/20 0.47
KMT2A Q03164 2/20 0.47
HDAC3 O15379 3/20 0.45
HDAC4 P56524 3/20 0.45
HDAC1 Q13547 3/20 0.45
HDAC7 Q8WUI4 3/20 0.45
HDAC2 Q92769 3/20 0.45
HDAC10 Q969S8 3/20 0.45
HDAC11 Q96DB2 3/20 0.45
HDAC8 Q9BY41 3/20 0.45
HDAC6 Q9UBN7 3/20 0.45
HDAC9 Q9UKV0 3/20 0.45
HDAC5 Q9UQL6 3/20 0.45
ITGB2 P05107 1/20 0.45
ICAM1 P05362 1/20 0.45

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
SCHEMBL7570162 1.00 HPGD (0.48) HPGDLMNANPC1RAB9ASMN1; SMN2
SCHEMBL7567950 0.94 HPGD (0.51) HPGDLMNANPC1RAB9ASMN1; SMN2
SCHEMBL1451542 0.81 PTGER3 (0.50) HPGDLMNASMN1; SMN2KMT2AHDAC3
SCHEMBL4287188 0.81 PTGER3 (0.50) HPGDLMNASMN1; SMN2KMT2AHDAC3
Hydrochloric Acid SCHEMBL9433691 0.79 PTGER3 (0.49) HPGDLMNASMN1; SMN2KMT2AHDAC3
SCHEMBL9433685 0.79 PTGER1 (0.41) SMN1; SMN2KMT2AALDH1A1MEN1POLB
SCHEMBL9433677 0.79 PTGER1 (0.41) SMN1; SMN2KMT2AALDH1A1MEN1POLB
SCHEMBL7565082 0.78 KMT2A (0.51) HPGDLMNANPC1RAB9ASMN1; SMN2
SCHEMBL8415411 0.78 PTPN1 (0.41) SMN1; SMN2EGFRALDH1A1
SCHEMBL8415409 0.78 PTPN1 (0.41) SMN1; SMN2EGFRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0934256-B1 PROCESS FOR THE PRODUCTION OF CYANOCINNAMAMIDES HONEYWELL INT INC (US) 2002-08-21 EP disclosed
EP-0934256-A1 PROCESS FOR THE PRODUCTION OF CYANOCINNAMAMIDES AlliedSignal Inc. (US) 1999-08-11 EP disclosed
WO-1998016501-A1 PROCESS FOR THE PRODUCTION OF CYANOCINNAMAMIDES ALLIEDSIGNAL INC. (US) 1998-04-23 WO disclosed
US-5654465-A Process for the production of cyanocinnamamides ALLIEDSIGNAL INC. (US) 1997-08-05 US disclosed