SCHEMBL7674902

SCHEMBL7674902

CNc1ccc(C(=O)Oc2c(C(C)=O)ccc(F)c2[C@H]2C[C@H]2NC(=O)Nc2ccc(Br)cn2)cn1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
NPC1 O15118 6/20 0.34
HCRTR2 O43614 4/20 0.34
MAPT P10636 3/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
FPR1 P21462 1/20 0.33
FPR2 P25090 1/20 0.33
NPSR1 Q6W5P4 2/20 0.33
MITF O75030 1/20 0.33
TSHR P16473 1/20 0.33
HCRTR1 O43613 2/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL7673150 1.00 RAB9A (0.36) RAB9ASMN1; SMN2KDM4ELMNANPC1
SCHEMBL7673146 1.00 RAB9A (0.36) RAB9ASMN1; SMN2KDM4ELMNANPC1
SCHEMBL7665577 0.93 SMN1; SMN2 (0.35) RAB9ASMN1; SMN2KDM4ELMNANPC1
SCHEMBL7664612 0.93 SMN1; SMN2 (0.35) RAB9ASMN1; SMN2KDM4ELMNANPC1
SCHEMBL7664617 0.93 SMN1; SMN2 (0.35) RAB9ASMN1; SMN2KDM4ELMNANPC1
SCHEMBL6566910 0.92 KDM4E (0.36) RAB9ASMN1; SMN2KDM4ELMNANPC1
SCHEMBL6567869 0.92 KDM4E (0.36) RAB9ASMN1; SMN2KDM4ELMNANPC1
SCHEMBL6566914 0.92 KDM4E (0.36) RAB9ASMN1; SMN2KDM4ELMNANPC1
SCHEMBL7673576 0.91 RAB9A (0.36) RAB9ASMN1; SMN2KDM4ELMNANPC1
SCHEMBL7673204 0.91 RAB9A (0.36) RAB9ASMN1; SMN2KDM4ELMNANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6486183-B1 Antivirals MEDIVIR AB (SE) 2002-11-26 US disclosed