SCHEMBL22306339

SCHEMBL22306339

Cc1ccc2c(=O)n(C)ccc2c1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.45
BRD4 O60885 5/20 0.41
PTPN1 P18031 1/20 0.37
BRD9 Q9H8M2 3/20 0.36
PDE3B Q13370 3/20 0.36
PDE3A Q14432 3/20 0.36
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
TAF1 P21675 1/20 0.35
BRPF1 P55201 1/20 0.35
CREBBP Q92793 1/20 0.35
CECR2 Q9BXF3 1/20 0.35
BRD7 Q9NPI1 1/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
KDM4E B2RXH2 1/20 0.34
KDM6A O15550 1/20 0.34
KDM4A O75164 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 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
SCHEMBL3341729 0.81 GAA (0.42) GAABRD4PTPN1BRD9MTNR1A
SCHEMBL24207286 0.81 GAA (0.42) GAABRD4PTPN1BRD9MTNR1A
SCHEMBL24204511 0.78 GAA (0.41) GAABRD4PTPN1BRD9MTNR1A
SCHEMBL17621624 0.76 BRD4 (0.41) GAABRD4PTPN1BRD9TAF1
SCHEMBL13833580 0.76 GAA (0.57) GAABRD4PTPN1BRD9BRD7
Hydrochloric Acid SCHEMBL30032118 0.74 BRD4 (0.39) GAABRD4PTPN1BRD9TAF1
SCHEMBL14502422 0.72 KDM4E (0.41) PTPN1PDE3BPDE3AMAPTKDM4E
SCHEMBL597709 0.72 TSHR (0.52) GAAPDE3BPDE3AKDM4ECYP1A2
SCHEMBL22306208 0.71 TP53 (0.42) GAABRD4BRD9TAF1BRPF1
SCHEMBL10050973 0.71 BRD9 (0.42) BRD4PTPN1BRD9PDE3BPDE3A

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-2020160180-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2020-08-06 WO disclosed