SCHEMBL22201524

SCHEMBL22201524

O=C(c1cccc(F)c1)c1nc(-c2ccncc2)nc2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.58
HPGD P15428 3/20 0.58
ALDH1A1 P00352 2/20 0.58
POLB P06746 2/20 0.58
GSK3A P49840 1/20 0.58
GSK3B P49841 1/20 0.58
ABCG2 Q9UNQ0 10/20 0.55
ABCB1 P08183 3/20 0.51
IGFBP3 P17936 1/20 0.49
MAPT P10636 1/20 0.48
KDM4E B2RXH2 3/20 0.47
PDE5A O76074 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46

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
SCHEMBL16038165 0.76 ABCG2 (0.53) LMNAHPGDALDH1A1POLBGSK3A
SCHEMBL15253806 0.74 ABCG2 (0.57) HPGDALDH1A1ABCG2MAPTKDM4E
SCHEMBL1083761 0.73 HPGD (1.00) LMNAHPGDALDH1A1POLBGSK3A
SCHEMBL22201525 0.73 LMNA (0.56) LMNAHPGDALDH1A1POLBGSK3A
SCHEMBL22201405 0.72 LMNA (0.58) LMNAHPGDALDH1A1POLBGSK3A
SCHEMBL22201623 0.72 ABCG2 (0.86) LMNAHPGDALDH1A1POLBGSK3A
SCHEMBL16039656 0.71 MAPT (0.59) LMNAHPGDALDH1A1POLBABCG2
SCHEMBL6308496 0.71 KMT2A (0.43) ALDH1A1GSK3BIGFBP3KMT2A
SCHEMBL7280956 0.71 ABCG2 (1.00) LMNAHPGDALDH1A1POLBGSK3A
SCHEMBL163563 0.70 IGFBP3 (0.43) ALDH1A1IGFBP3SMN1; SMN2KMT2AMEN1

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