SCHEMBL15917128

SCHEMBL15917128

C#CCCc1ccc2ccc3cccc4ccc1c2c34

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.53
MEN1 O00255 1/20 0.53
ALDH1A1 P00352 7/20 0.43
KDM4E B2RXH2 6/20 0.43
HPGD P15428 5/20 0.41
HSD17B10 Q99714 4/20 0.41
CYP3A4 P08684 2/20 0.41
TSHR P16473 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CYP1A1 P04798 2/20 0.40
CYP1B1 Q16678 2/20 0.40
CYP1A2 P05177 4/20 0.39
ERBB2 P04626 1/20 0.39
FYN P06241 1/20 0.39
MAOA P21397 1/20 0.39
ACHE P22303 1/20 0.39
AHR P35869 1/20 0.39
POLB P06746 2/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL29597648 0.79 KMT2A (0.71) KMT2AMEN1ALDH1A1KDM4EHPGD
Pyrene SCHEMBL3424787 0.79 KMT2A (0.71) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL700680 0.79 KMT2A (0.71) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL6412633 0.77 KMT2A (0.69) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL2123579 0.76 KMT2A (0.62) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL1607476 0.76 MEN1 (0.50) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL28097582 0.76 CYP1A2 (0.48) TDP1CYP1A2CYP2D6MITFMTNR1A
SCHEMBL1821410 0.76 KMT2A (0.57) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL397619 0.76 KMT2A (0.57) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL19899687 0.76 KMT2A (0.57) KMT2AMEN1ALDH1A1KDM4EHPGD

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-9885082-B2 Embodiments of a probe and method for targeting nucleic acids UNIVERSITY OF IDAHO (US) 2018-02-06 US disclosed
US-20140220573-A1 EMBODIMENTS OF A PROBE AND METHOD FOR TARGETING NUCLEIC ACIDS UNIVERSITY OF IDAHO (US) 2014-08-07 US disclosed