SCHEMBL21350834

SCHEMBL21350834

C=C1NCCc2c(F)cccc21

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 1/20 0.41
PARP1 P09874 6/20 0.39
PARP10 Q53GL7 5/20 0.39
PARP11 Q9NR21 4/20 0.39
CYP19A1 P11511 2/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
HTR7 P34969 2/20 0.36
TYMS P04818 1/20 0.36
NISCH Q9Y2I1 1/20 0.36
MAPT P10636 1/20 0.32
DRD2 P14416 1/20 0.32
DRD3 P35462 1/20 0.32
PDPK1 O15530 1/20 0.32

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
SCHEMBL29587371 0.78 PARP1 (0.64) SRD5A1PARP1PARP10PARP11PDPK1
SCHEMBL6421827 0.78 PARP1 (0.64) SRD5A1PARP1PARP10PARP11PDPK1
SCHEMBL16230718 0.74 PARP1 (0.39) PARP1PARP10PARP11NISCH
SCHEMBL550313 0.72 NOTUM (0.44) SRD5A1PARP1PARP10PARP11HTR7
SCHEMBL29353774 0.72 NOTUM (0.44) SRD5A1PARP1PARP10PARP11HTR7
SCHEMBL24459353 0.69 SRD5A1 (0.39) SRD5A1CYP19A1CYP11B1CYP11B2HTR7
SCHEMBL15395880 0.69 SRD5A1 (0.42) SRD5A1CYP19A1CYP11B1CYP11B2HTR7
SCHEMBL15311783 0.69 NISCH (0.42) PARP1PARP10PARP11HTR7NISCH
SCHEMBL1159918 0.68 PARP10 (0.59) PARP1PARP10PARP11PDPK1
SCHEMBL16559357 0.66 SRD5A1 (0.54) SRD5A1CYP19A1CYP11B1CYP11B2TYMS

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-2019173804-A1 INHIBITORS OF PROTEIN ARGININE METHYLTRANSFERASE 5 (PRMT5), PHARMACEUTICAL PRODUCTS THEREOF, AND METHODS THEREOF PHARMABLOCK SCIENCES (NANJING), INC. (CN) 2019-09-12 WO disclosed