SCHEMBL16557129

SCHEMBL16557129

CCCCN1C(=O)c2ccc3c4c(ccc(c24)C1=O)C(=O)N(CCCS(=O)(=O)O)C3=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.53
▸ KMT2A Q03164 4/20 0.53
▸ ALDH1A1 P00352 3/20 0.53
▸ RGS12 O14924 2/20 0.53
▸ HTT P42858 2/20 0.53
▸ LMNA P02545 2/20 0.53
▸ KDM4E B2RXH2 1/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ PABPC1 P11940 1/20 0.53
▸ RECQL P46063 1/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ TERT O14746 5/20 0.50
▸ MAPK1 P28482 2/20 0.47
▸ POLB P06746 2/20 0.47
▸ MAPT P10636 2/20 0.47
▸ USP2 O75604 1/20 0.47
▸ ATM Q13315 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ TLR9 Q9NR96 1/20 0.47

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
SCHEMBL16557130 0.94 STAT3 (0.55) MEN1KMT2AALDH1A1RGS12HTT
SCHEMBL16558635 0.94 MEN1 (0.53) MEN1KMT2AALDH1A1RGS12HTT
SCHEMBL14023220 0.92 KDM4E (0.61) MEN1KMT2AALDH1A1RGS12HTT
SCHEMBL16558636 0.89 STAT3 (0.55) MEN1KMT2AALDH1A1RGS12HTT
SCHEMBL24813700 0.86 STAT3 (0.57) MEN1KMT2AALDH1A1RGS12HTT
SCHEMBL30938136 0.85 TERT (0.65) MEN1KMT2AALDH1A1RGS12HTT
SCHEMBL13223803 0.85 TERT (0.65) MEN1KMT2AALDH1A1RGS12HTT
SCHEMBL21081429 0.82 TERT (0.61) MEN1KMT2AALDH1A1RGS12HTT
SCHEMBL14023201 0.82 KDM4E (0.55) MEN1KMT2AALDH1A1RGS12HTT
SCHEMBL14156552 0.82 MEN1 (0.65) MEN1KMT2AALDH1A1RGS12HTT

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-9431612-B2 Methods for tailoring electrode work function using interfacial modifiers for use in organic electronics THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2016-08-30 — — US disclosed
US-20150072446-A1 METHODS FOR TAILORING ELECTRODE WORK FUNCTION USING INTERFACIAL MODIFIERS FOR USE IN ORGANIC ELECTRONICS NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2015-03-12 — — US disclosed
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