SCHEMBL16993485

SCHEMBL16993485

CCCC(C(=O)O)N1Cc2ccccc2C1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 9/20 0.51
SLC6A2 P23975 8/20 0.51
SLC6A4 P31645 5/20 0.45
ALOX15 P16050 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
NOTUM Q6P988 1/20 0.42
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
DPP8 Q6V1X1 2/20 0.41
DPP9 Q86TI2 2/20 0.41
DPP7 Q9UHL4 2/20 0.41
PPARG P37231 2/20 0.41
PPARA Q07869 2/20 0.41
DPP4 P27487 1/20 0.41
NAMPT P43490 2/20 0.40

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
SCHEMBL17574447 0.79 MEN1 (0.42) ALOX15KDM4EMEN1KMT2ANOTUM
SCHEMBL17574446 0.79 MEN1 (0.42) ALOX15KDM4EMEN1KMT2ANOTUM
SCHEMBL6006397 0.78 LMNA (0.62) ALOX15KDM4EMEN1KMT2AMAPT
SCHEMBL4828036 0.76 KDM4E (0.50) KDM4EMEN1KMT2ANOTUMMAPT
SCHEMBL16267064 0.76 ALOX15 (0.74) ALOX15KDM4EMEN1KMT2AMAPT
SCHEMBL16267065 0.76 ALOX15 (0.74) ALOX15KDM4EMEN1KMT2AMAPT
SCHEMBL9850503 0.75 PTAFR (0.54) SLC6A3SLC6A2SLC6A4MEN1KMT2A
SCHEMBL21501988 0.74 MEN1 (0.47) SLC6A3SLC6A2KDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL9850501 0.74 PTAFR (0.53) SLC6A3SLC6A2SLC6A4MEN1KMT2A
SCHEMBL14432541 0.74 SLC6A2 (0.46) SLC6A3SLC6A2SLC6A4ALOX15KDM4E

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-20160355802-A1 Compositions and Methods Of Use Thereof For Making Polypeptides With Many Instances Of Nonstandard Amino Acids YALE UNIVERSITY 2016-12-08 US disclosed
WO-2015120287-A2 COMPOSITIONS AND METHODS OF USE THEREOF FOR MAKING POLYPEPTIDES WITH MANY INSTANCES OF NONSTANDARD AMINO ACIDS YALE UNIVERSITY (US) 2015-08-13 WO disclosed