SCHEMBL9259987

SCHEMBL9259987

Cc1cccn2c(=O)c(-c3nnn(CCc4ccccc4)n3)cnc12

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.50
MAPT P10636 3/20 0.50
LMNA P02545 1/20 0.42
HDAC8 Q9BY41 1/20 0.41
HIF1A Q16665 2/20 0.39
KDM4E B2RXH2 6/20 0.38
ALDH1A1 P00352 5/20 0.38
HPGD P15428 3/20 0.38
STAT6 P42226 1/20 0.38
POLB P06746 1/20 0.37
NPSR1 Q6W5P4 2/20 0.36
NPC1 O15118 2/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36
ATM Q13315 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CASR P41180 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL9210655 0.87 TP53 (0.39) TP53MAPTLMNAKDM4EALDH1A1
Hydrochloric Acid SCHEMBL9219227 0.86 TP53 (0.39) TP53MAPTLMNAKDM4EALDH1A1
SCHEMBL9255747 0.85 TP53 (0.40) TP53MAPTLMNAHDAC8KDM4E
SCHEMBL9215578 0.84 MAPT (0.37) TP53MAPTLMNAHDAC8KDM4E
SCHEMBL9256673 0.82 TP53 (0.39) TP53MAPTLMNAHDAC8KDM4E
SCHEMBL9255151 0.82 TP53 (0.40) TP53MAPTLMNAHDAC8KDM4E
SCHEMBL9207052 0.82 TP53 (0.38) TP53MAPTLMNAKDM4EALDH1A1
SCHEMBL9260614 0.81 MAPT (0.40) TP53MAPTLMNAHDAC8KDM4E
SCHEMBL9213292 0.81 MAPT (0.38) TP53MAPTLMNAHDAC8HIF1A
SCHEMBL9255403 0.81 MAPT (0.38) TP53MAPTLMNAHDAC8KDM4E

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
US-5475000-A Antiulcer agents CHINOIN GYOGYSZER-ES VEGYESZETI TERMEKEK GYARA RT. (HU) 1995-12-12 US disclosed
EP-0641340-A1 NEW 3-(SUBSTITUTED TETRAZOLYL)-4-OXO-4H-PYRIDO- 1,2-a]PYRIMIDINES, SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME CHINOIN Gyogyszer és Vegyészeti Termékek Gyára RT. (HU) 1995-03-08 EP disclosed
WO-1993004065-A1 NEW 3-(SUBSTITUTED TETRAZOLYL)-4-OXO-4H-PYRIDO-[1,2-a]PYRIMIDINES, SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME CHINOIN GYÓGYSZER- ÉS VEGYÉSZETI TERMÉKEK GYÁRA RT. (HU) 1993-03-04 WO disclosed