SCHEMBL22201481

SCHEMBL22201481

c1cncc(Oc2cc3ncccc3c(Nc3ccc4nc(C5CC5)sc4c3)n2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 2/20 0.37
CDK1 P06493 2/20 0.36
ABCG2 Q9UNQ0 3/20 0.35
ABCB1 P08183 2/20 0.35
PDE10A Q9Y233 2/20 0.35
TTBK1 Q5TCY1 1/20 0.34
TTBK2 Q6IQ55 1/20 0.34
MEN1 O00255 1/20 0.34
USP2 O75604 1/20 0.34
KMT2A Q03164 1/20 0.34
SYK P43405 1/20 0.33
P2RX3 P56373 1/20 0.33
EGFR P00533 1/20 0.33
ERBB4 Q15303 1/20 0.33
CYP1A2 P05177 1/20 0.33
GRM4 Q14833 1/20 0.33
ABL1 P00519 1/20 0.33
ADORA3 P0DMS8 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 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
SCHEMBL22201321 0.84 BRAF (0.36) ABCG2ABCB1PDE10AMEN1KMT2A
SCHEMBL22201242 0.84 HTR2C (0.38) ABCG2ABCB1MEN1KMT2AP2RX3
SCHEMBL22201239 0.83 PDE5A (0.39) CSF1RABCG2ABCB1USP2KMT2A
SCHEMBL22201366 0.83 MAPT (0.39) ABCG2ABCB1MEN1USP2KMT2A
SCHEMBL22201653 0.81 TGFBR1 (0.41) ABCG2ABCB1P2RX3ADORA3ALDH1A1
SCHEMBL22201243 0.81 ABCG2 (0.35) ABCG2ABCB1P2RX3ALDH1A1MAPT
SCHEMBL22201226 0.79 PRKCH (0.37) PDE10ASYKP2RX3CYP1A2GRM4
SCHEMBL22201537 0.79 KDM4E (0.42) PDE10AMEN1KMT2AP2RX3CYP1A2
SCHEMBL22201586 0.79 PRKCH (0.47) ABCG2ABCB1MEN1KMT2ASYK
SCHEMBL22201368 0.79 SYK (0.45) ABCG2ABCB1PDE10AMEN1KMT2A

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