SCHEMBL7955073

SCHEMBL7955073

[CH2]C(=O)Nc1ccccc1OCCCCC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.60
POLB P06746 2/20 0.56
TSHR P16473 1/20 0.56
PTPN1 P18031 3/20 0.56
EBP Q15125 1/20 0.56
SIGMAR1 Q99720 1/20 0.56
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
MAPT P10636 4/20 0.52
LMNA P02545 3/20 0.52
MEN1 O00255 2/20 0.52
NR1I2 O75469 1/20 0.52
CHRM2 P08172 1/20 0.52
CYP3A4 P08684 1/20 0.52
ADRA2A P08913 1/20 0.52
OPRK1 P41145 1/20 0.52
HTR2B P41595 1/20 0.52
SLC6A3 Q01959 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
GAA P10253 2/20 0.52

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
SCHEMBL11482522 0.98 KMT2A (0.59) KMT2APOLBTSHRPTPN1EBP
SCHEMBL7952996 0.98 KMT2A (0.59) KMT2APOLBTSHRPTPN1EBP
SCHEMBL7956543 0.95 KMT2A (0.66) KMT2APOLBTSHRPTPN1EBP
SCHEMBL7959643 0.91 NPC1 (0.65) KMT2APOLBTSHRPTPN1NPC1
SCHEMBL18554186 0.86 KMT2A (0.62) KMT2APOLBTSHRPTPN1EBP
SCHEMBL248401 0.86 KMT2A (0.66) KMT2APOLBTSHRPTPN1EBP
SCHEMBL11482525 0.85 KMT2A (0.64) KMT2APOLBTSHRPTPN1EBP
SCHEMBL14625066 0.85 KMT2A (0.64) KMT2APOLBTSHRPTPN1EBP
SCHEMBL7952997 0.85 KMT2A (0.64) KMT2APOLBTSHRPTPN1EBP
SCHEMBL8930342 0.85 MAPT (0.64) KMT2APOLBTSHRPTPN1EBP

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-6245779-B1 ANALGESICS; ANTIINFLAMMATORY AGENTS OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2001-06-12 US disclosed
CN-1262685-A Naphthyridine derivatives OTSUKA PHARMA CO LTD (JP) 2000-08-09 CN disclosed
EP-0997463-A1 NAPHTHYRIDINE DERIVATIVES OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2000-05-03 EP disclosed