SCHEMBL9200324

SCHEMBL9200324

O=C1c2ccccc2C2(c3ccnc4ccccc34)OCCN12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.38
MAPT P10636 3/20 0.38
RAB9A P51151 3/20 0.38
TP53 P04637 2/20 0.38
PTK2B Q14289 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ESR1 P03372 1/20 0.38
ACVR1 Q04771 2/20 0.36
ACVR1B P36896 2/20 0.36
TGFBR1 P36897 2/20 0.36
BMPR1B O00238 1/20 0.36
PDGFRB P09619 1/20 0.36
KIT P10721 1/20 0.36
PDGFRA P16234 1/20 0.36
BMPR1A P36894 1/20 0.36
ACVRL1 P37023 1/20 0.36
CNR1 P21554 1/20 0.35
NCF1 P14598 2/20 0.35
POLB P06746 1/20 0.34
ELANE P08246 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
SCHEMBL9199522 0.81 SLC6A3 (0.40) NPC1MAPTSMN1; SMN2POLBKMT2A
SCHEMBL9201620 0.80 NPC1 (0.37) NPC1MAPTRAB9ASMN1; SMN2POLB
SCHEMBL9198960 0.77 TDP1 (0.37) NPC1TP53POLBKMT2AMEN1
SCHEMBL9197598 0.76 RAF1 (0.36) NPC1RAB9ASMN1; SMN2POLBELANE
SCHEMBL9740266 0.76 SLC22A12 (0.38) NPC1MAPTRAB9ATP53PTK2B
SCHEMBL9201037 0.76 RXFP1 (0.42) NPC1MAPTRAB9ASMN1; SMN2POLB
SCHEMBL9196278 0.75 APAF1 (0.39) NPC1RAB9ASMN1; SMN2POLBKMT2A
SCHEMBL9213340 0.75 NPC1 (0.36) NPC1MAPTRAB9ATP53PTK2B
SCHEMBL9197319 0.75 NPC1 (0.60) NPC1MAPTRAB9ATP53PTK2B
SCHEMBL9196127 0.74 NPC1 (0.51) NPC1MAPTSMN1; SMN2POLBKMT2A

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-0575425-B1 USE OF OXAZOLO- 2,3-a]ISOINDOLE AND IMIDAZO 2,1-a]ISOINDOLE DERIVATIVES AS ANTIVIRAL DRUGS, AND NEW OXAZOLO 2,3-a]ISOINDOLE DERIVATIVES BOEHRINGER MANNHEIM GMBH (DE) 1995-10-11 EP disclosed
EP-0575425-A1 USE OF OXAZOLO- 2,3-a]ISOINDOLE AND IMIDAZO 2,1-a]ISOINDOLE DERIVATIVES AS ANTIVIRAL DRUGS, AND NEW OXAZOLO 2,3-a]ISOINDOLE DERIVATIVES. BOEHRINGER MANNHEIM GMBH (DE) 1993-12-29 EP disclosed
WO-1992016207-A1 USE OF OXAZOLO-[2,3-a]ISOINDOLE AND IMIDAZO[2,1-a]ISOINDOLE DERIVATIVES AS ANTIVIRAL DRUGS, AND NEW OXAZOLO[2,3-a]ISOINDOLE DERIVATIVES BOEHRINGER MANNHEIM GMBH (DE) 1992-10-01 WO disclosed