SCHEMBL17476331

SCHEMBL17476331

O=P(O)(O)CCCCCCCCCCCCCCCCCOc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.59
FDPS P14324 4/20 0.54
HDAC1 Q13547 3/20 0.53
HDAC2 Q92769 3/20 0.53
HDAC3 O15379 1/20 0.53
HDAC4 P56524 1/20 0.53
HDAC7 Q8WUI4 1/20 0.53
HDAC10 Q969S8 1/20 0.53
HDAC11 Q96DB2 1/20 0.53
HDAC8 Q9BY41 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
HDAC9 Q9UKV0 1/20 0.53
HDAC5 Q9UQL6 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
HTR1B P28222 2/20 0.52
S1PR2 O95136 2/20 0.50
S1PR1 P21453 2/20 0.50
S1PR3 Q99500 2/20 0.50
LPAR2 Q9HBW0 2/20 0.50

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
SCHEMBL17476358 1.00 KCNA3 (0.59) KCNA3FDPSHDAC1HDAC2HDAC3
SCHEMBL17476342 1.00 KCNA3 (0.59) KCNA3FDPSHDAC1HDAC2HDAC3
SCHEMBL17476344 1.00 KCNA3 (0.59) KCNA3FDPSHDAC1HDAC2HDAC3
SCHEMBL11436349 1.00 KCNA3 (0.59) KCNA3FDPSHDAC1HDAC2HDAC3
SCHEMBL17476340 1.00 KCNA3 (0.59) KCNA3FDPSHDAC1HDAC2HDAC3
SCHEMBL5053425 1.00 KCNA3 (0.59) KCNA3FDPSHDAC1HDAC2HDAC3
SCHEMBL9785227 0.92 KCNA3 (0.58) KCNA3FDPSHDAC1HDAC2HDAC3
SCHEMBL13861919 0.90 HDAC1 (0.59) HDAC1HDAC2HDAC3HDAC4HDAC7
SCHEMBL13861923 0.88 HDAC1 (0.56) KCNA3HDAC1HDAC2HDAC3HDAC4
SCHEMBL8353114 0.86 CYP2C9 (0.59) KCNA3FDPSCYP2C9CYP2C19HTR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160035903-A1 THIN-FILM TRANSISTOR OSAKA UNIVERSITY (JP) 2016-02-04 US disclosed