SCHEMBL17580555

SCHEMBL17580555

CC(C)Oc1cc(-c2ccn(C)n2)ccc1NC=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 2/20 0.38
▸ KEAP1 Q14145 1/20 0.37
▸ TTK P33981 2/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ SCN4A P35499 1/20 0.35
▸ JMJD6 Q6NYC1 2/20 0.35
▸ CYP19A1 P11511 1/20 0.35
▸ PIK3CD O00329 1/20 0.34
▸ PIP5K1C O60331 1/20 0.34
▸ PIK3CA P42336 1/20 0.34
▸ PIK3CB P42338 1/20 0.34
▸ PI4KA P42356 1/20 0.34
▸ PIK3CG P48736 1/20 0.34
▸ PI4KB Q9UBF8 1/20 0.34
▸ MKNK1 Q9BUB5 3/20 0.34
▸ MKNK2 Q9HBH9 3/20 0.34
▸ DRD2 P14416 1/20 0.34
▸ HTR2A P28223 1/20 0.34
▸ HTR2C P28335 1/20 0.34
▸ DRD3 P35462 1/20 0.34

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
SCHEMBL18300032 0.86 TTK (0.43) KEAP1TTKKMT2ASCN4AJMJD6
SCHEMBL15507823 0.79 TTK (0.55) TTKMKNK1MKNK2
SCHEMBL15283278 0.76 KEAP1 (0.50) SYKKEAP1KMT2ASCN4AJMJD6
SCHEMBL15283609 0.73 XDH (0.43) SYKKEAP1KMT2ASCN4AJMJD6
SCHEMBL4188651 0.73 PDE4D (0.35) KMT2ASCN4AUSP30KCNH2
SCHEMBL22710175 0.72 CYP19A1 (0.45) KEAP1KMT2ASCN4AJMJD6CYP19A1
SCHEMBL17580571 0.71 P2RX3 (0.41) KMT2ACYP19A1DRD2HTR2AHTR2C
SCHEMBL17580506 0.71 HPGD (0.37) KMT2ACYP19A1P2RX3BRPF1
SCHEMBL17580381 0.70 AAK1 (0.41) MKNK1MKNK2
SCHEMBL17580433 0.70 HTT (0.47) —

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-2834248-B1 NOVEL THIENOPYRIMIDINE DERIVATIVES, PROCESSES FOR THE PREPARATION THEREOF AND THERAPEUTIC USES THEREOF SANOFI SA (FR) 2016-03-16 — — EP disclosed
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