SCHEMBL7745980

SCHEMBL7745980

CC(=O)OCCCCn1c(CCl)nc2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.54
ATM Q13315 1/20 0.54
SMN1; SMN2 Q16637 6/20 0.53
LMNA P02545 2/20 0.53
PKM P14618 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
TP53 P04637 6/20 0.52
MAPT P10636 4/20 0.52
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
GAA P10253 2/20 0.50
POLB P06746 2/20 0.49
RECQL P46063 1/20 0.48
NPC1 O15118 1/20 0.48
HTT P42858 1/20 0.47

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
SCHEMBL16695989 0.85 ALDH1A1 (0.41) RAB9AATMSMN1; SMN2LMNAPKM
SCHEMBL7741979 0.80 FAAH (0.56) SMN1; SMN2LMNATP53MAPTGAA
SCHEMBL20769894 0.78 SMN1; SMN2 (0.52) RAB9AATMSMN1; SMN2NPSR1TP53
SCHEMBL7745897 0.78 RAB9A (0.46) RAB9AATMSMN1; SMN2LMNAPKM
SCHEMBL30184968 0.78 TLR8 (0.65) SMN1; SMN2LMNATP53MAPTMEN1
SCHEMBL28036974 0.78 TLR8 (0.65) SMN1; SMN2LMNATP53MAPTMEN1
SCHEMBL28036451 0.78 TLR8 (0.65) SMN1; SMN2LMNATP53MAPTMEN1
SCHEMBL7741401 0.76 MEN1 (0.59) RAB9ASMN1; SMN2LMNATP53MAPT
SCHEMBL18148387 0.76 RAB9A (0.64) RAB9ASMN1; SMN2LMNATP53MAPT
SCHEMBL16696060 0.76 PSEN1 (0.40) SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6774134-B2 FOR THERAPY OF RESPIRATORY SYNCYTIAL VIRUS INFECTION BRISTOL-MYERS SQUIBB COMPANY 2004-08-10 US disclosed
US-6774134-B2 FOR THERAPY OF RESPIRATORY SYNCYTIAL VIRUS INFECTION BRISTOL-MYERS SQUIBB COMPANY 2004-08-10 US disclosed