SCHEMBL22201282

SCHEMBL22201282

Fc1cccc(Nc2nc(-c3ccncc3)cc3ccccc23)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.64
LMNA P02545 2/20 0.64
ALDH1A1 P00352 2/20 0.64
POLB P06746 2/20 0.64
GSK3A P49840 1/20 0.64
GSK3B P49841 1/20 0.64
ABCG2 Q9UNQ0 11/20 0.54
PRKCH P24723 1/20 0.54
PRKCE Q02156 1/20 0.54
CYP1A1 P04798 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP1B1 Q16678 1/20 0.52
EGFR P00533 1/20 0.48
FADS1 O60427 1/20 0.48
KDM4E B2RXH2 2/20 0.47
MAPT P10636 1/20 0.47
PDE5A O76074 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 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
SCHEMBL16941497 0.86 HPGD (0.65) HPGDLMNAALDH1A1POLBGSK3A
SCHEMBL22201369 0.84 LMNA (0.63) HPGDLMNAALDH1A1POLBGSK3A
SCHEMBL22201279 0.80 ABCG2 (0.85) HPGDLMNAALDH1A1POLBGSK3A
SCHEMBL29007280 0.78 ADORA3 (0.57) HPGDLMNAALDH1A1POLBABCG2
SCHEMBL1083761 0.78 HPGD (1.00) HPGDLMNAALDH1A1POLBGSK3A
SCHEMBL22201257 0.77 FGFR2 (0.62) HPGDLMNAPRKCHPRKCECYP1A2
SCHEMBL30390170 0.76 ABCG2 (0.60) HPGDLMNAALDH1A1ABCG2CYP1A2
SCHEMBL29007307 0.76 ABCG2 (0.60) HPGDLMNAALDH1A1ABCG2CYP1A2
SCHEMBL22201655 0.76 PRKCH (0.48) ALDH1A1PRKCHPRKCECYP1A2KDM4E
SCHEMBL22201268 0.76 TGFBR1 (0.51) PRKCHPRKCEEGFR

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