SCHEMBL6672691

SCHEMBL6672691

Oc1c(-c2ccccc2)cc(-c2ccccc2)cc1-n1nc2ccccc2n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
PTPN1 P18031 1/20 0.46
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.43
HPGD P15428 3/20 0.40
KDM4E B2RXH2 2/20 0.40
BACE1 P56817 2/20 0.38
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
ALDH1A1 P00352 4/20 0.37
NPSR1 Q6W5P4 2/20 0.37
MAPT P10636 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
USP7 Q93009 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
ALOX5 P09917 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
SCHEMBL28325434 0.81 NPC1 (0.43) NPC1RAB9APTPN1LMNAPOLB
SCHEMBL22363749 0.80 HDAC4 (0.47) NPC1RAB9ALMNAPOLBHPGD
SCHEMBL9408808 0.79 NPC1 (0.43) NPC1RAB9APTPN1LMNAPOLB
SCHEMBL27553358 0.78 KDM4E (0.44) NPC1RAB9ALMNAHPGDKDM4E
SCHEMBL1703200 0.77 LMNA (0.63) NPC1RAB9ALMNAPOLBHPGD
SCHEMBL20591061 0.77 FFAR1 (0.43) NPC1RAB9APTPN1POLB
SCHEMBL29595889 0.76 PTPN1 (0.64) PTPN1HPGDBACE1CRHBPCRHR2
SCHEMBL4979055 0.75 NPC1 (0.43) NPC1RAB9APTPN1LMNAPOLB
SCHEMBL11408951 0.75 NPC1 (0.43) NPC1RAB9ALMNAPOLBHPGD
SCHEMBL309670 0.74 PTPN1 (0.67) PTPN1HPGDBACE1CRHBPCRHR2

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
EP-0992363-B1 Heat-sensitive recording material FUJI PHOTO FILM CO LTD (JP) 2004-09-22 EP disclosed
EP-0992363-A1 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. (JP) 2000-04-12 EP disclosed
US-4663642-A DISCOLORATION INHIBITION RICOH COMPANY, LTD. (JP) 1987-05-05 US disclosed