SCHEMBL22201485

SCHEMBL22201485

FC(F)(F)c1cnccc1-c1cc2ncccc2c(Nc2ccc3nc(C4CC4)sc3c2)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ULK1 O75385 5/20 0.40
ULK2 Q8IYT8 1/20 0.40
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
MAPT P10636 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
CYP2C19 P33261 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 1/20 0.35
ABCB1 P08183 1/20 0.34
ABCG2 Q9UNQ0 1/20 0.34
ABL1 P00519 1/20 0.33

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
SCHEMBL22201326 0.93 ULK1 (0.40) ULK1ULK2KDM4EMEN1ALDH1A1
SCHEMBL22201494 0.89 JAK2 (0.36) ULK1ULK2KDM4ELMNACYP1A2
SCHEMBL22201489 0.88 SYK (0.37) KDM4EMEN1CYP1A2CYP3A4MAPT
SCHEMBL22201488 0.87 ADORA3 (0.37) KDM4EMEN1CYP1A2KMT2AKDR
SCHEMBL22201492 0.87 P2RX3 (0.32) ULK1ULK2KDM4EMEN1ALDH1A1
SCHEMBL22201536 0.86 ACP1 (0.36) ULK1ULK2CYP1A2CYP2C19ACP1
SCHEMBL22201423 0.86 TRPV1 (0.41) ULK1ULK2TRPV1
SCHEMBL22201324 0.86 ADORA3 (0.39) KDM4EMEN1ALDH1A1LMNACYP1A2
SCHEMBL22201531 0.86 ABL1 (0.38) KDM4EMEN1ALDH1A1KMT2AABL1
SCHEMBL22201366 0.84 MAPT (0.39) KDM4EMEN1ALDH1A1LMNACYP1A2

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
WO-2020142748-A1 METHODS AND MATERIALS FOR INCREASING TRANSCRIPTION FACTOR EB POLYPEPTIDE LEVELS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2020-07-09 WO disclosed