SCHEMBL27635892

SCHEMBL27635892

Cc1cccc(-c2nc3ccccc3c(=O)[nH]2)c1C

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GUSB P08236 9/20 0.62
HPGD P15428 2/20 0.62
KDM4E B2RXH2 1/20 0.62
TNKS2 Q9H2K2 6/20 0.58
PARP1 P09874 5/20 0.58
TNKS O95271 5/20 0.58
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
ALDH1A1 P00352 1/20 0.52
MAPT P10636 1/20 0.52
ALOX15 P16050 1/20 0.52
HSD17B10 Q99714 1/20 0.52
APOBEC3G Q9HC16 1/20 0.52
PARP2 Q9UGN5 1/20 0.51

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
SCHEMBL29900574 1.00 GUSB (0.62) GUSBHPGDKDM4ETNKS2PARP1
SCHEMBL29784109 0.89 GUSB (0.68) GUSBHPGDKDM4ETNKS2PARP1
SCHEMBL1461157 0.89 GUSB (0.68) GUSBHPGDKDM4ETNKS2PARP1
SCHEMBL28214511 0.83 GUSB (0.57) GUSBHPGDKDM4ETNKS2PARP1
SCHEMBL28135155 0.81 GUSB (0.69) GUSBHPGDKDM4ETNKS2PARP1
SCHEMBL6695759 0.79 TNKS2 (0.81) GUSBHPGDKDM4ETNKS2PARP1
SCHEMBL8957840 0.78 NPC1 (0.78) HPGDKDM4ENPC1RAB9AALDH1A1
SCHEMBL31138463 0.77 GUSB (0.81) GUSBHPGDKDM4ETNKS2PARP1
SCHEMBL296097 0.77 GUSB (1.00) GUSBHPGDKDM4ETNKS2PARP1
SCHEMBL802560 0.77 GUSB (0.68) GUSBHPGDKDM4ETNKS2PARP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115010671-B One-step synthesis method of 2-substituted quinazolinone 江苏大学 2023-10-10 CN disclosed
CN-115010671-A One-step synthesis method of 2-substituted quinazolinone 江苏大学 2022-09-06 CN disclosed
CN-1708306-A Quinazolinone compounds as calcilytics NPS PHARMA INC (US) 2005-12-14 CN disclosed