SCHEMBL12855755

SCHEMBL12855755

O=C(Nc1cc(C(F)(F)F)ccc1N1CCC[C@@]2(Br)CCCC[C@H]12)c1ccncc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRPK1 Q96SB4 6/20 0.59
SRPK2 P78362 2/20 0.59
SRPK3 Q9UPE1 2/20 0.59
KDR P35968 2/20 0.59
POLB P06746 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CYP1A2 P05177 2/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
ALDH1A1 P00352 4/20 0.42
MAPT P10636 3/20 0.42
MEN1 O00255 1/20 0.42
TSHR P16473 1/20 0.42
KMT2A Q03164 1/20 0.42
GAA P10253 2/20 0.40
LMNA P02545 1/20 0.40
CLK1 P49759 1/20 0.40
CLK2 P49760 1/20 0.40
DYRK1A Q13627 1/20 0.40
CLK4 Q9HAZ1 1/20 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
SCHEMBL20554756 0.81 SRPK1 (0.69) SRPK1SRPK2SRPK3KDRPOLB
SCHEMBL3485991 0.81 SRPK1 (0.69) SRPK1SRPK2SRPK3KDRPOLB
SCHEMBL1110821 0.81 SRPK1 (0.66) SRPK1SRPK2SRPK3KDRPOLB
SCHEMBL3485994 0.81 SRPK1 (0.69) SRPK1SRPK2SRPK3KDRPOLB
SCHEMBL1110816 0.81 SRPK1 (0.66) SRPK1SRPK2SRPK3KDRPOLB
SCHEMBL1110819 0.81 SRPK1 (0.66) SRPK1SRPK2SRPK3KDRPOLB
SCHEMBL12855743 0.81 SRPK1 (0.66) SRPK1SRPK2SRPK3KDRPOLB
SCHEMBL3485920 0.76 SRPK1 (0.98) SRPK1SRPK2SRPK3KDRPOLB
SCHEMBL1110544 0.75 SRPK1 (1.00) SRPK1SRPK2SRPK3KDRPOLB
SCHEMBL1110476 0.75 SRPK1 (1.00) SRPK1SRPK2SRPK3KDRPOLB

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
EP-2279750-A1 ANILINE DERIVATIVE HAVING ANTI-RNA VIRAL ACTIVITY KinoPharma, Inc. (JP) 2011-02-02 EP disclosed