SCHEMBL9867464

SCHEMBL9867464

Clc1ccccc1-c1nc2ncccc2o1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.68
NPC1 O15118 9/20 0.68
RAB9A P51151 8/20 0.68
SMN1; SMN2 Q16637 7/20 0.68
MAPT P10636 7/20 0.68
ALDH1A1 P00352 4/20 0.68
GAA P10253 2/20 0.68
HPGD P15428 4/20 0.66
HSD17B10 Q99714 2/20 0.66
LMNA P02545 1/20 0.51
TSHR P16473 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
TP53 P04637 5/20 0.49
GRM5 P41594 1/20 0.47
ALOX12 P18054 1/20 0.46
HAVCR2 Q8TDQ0 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL11646929 0.85 ALDH1A1 (0.59) KDM4ENPC1RAB9ASMN1; SMN2MAPT
SCHEMBL9868757 0.82 NPC1 (0.57) KDM4ENPC1RAB9ASMN1; SMN2MAPT
SCHEMBL7258548 0.81 SMN1; SMN2 (1.00) KDM4ENPC1RAB9ASMN1; SMN2MAPT
SCHEMBL4600240 0.81 KDM4E (0.68) KDM4ENPC1RAB9ASMN1; SMN2MAPT
SCHEMBL9646773 0.81 KDM4E (1.00) KDM4ENPC1RAB9ASMN1; SMN2MAPT
SCHEMBL11645613 0.81 KDM4E (0.68) KDM4ENPC1RAB9ASMN1; SMN2MAPT
SCHEMBL13522986 0.81 NPC1 (0.69) KDM4ENPC1RAB9ASMN1; SMN2MAPT
SCHEMBL220575 0.81 KDM4E (0.68) KDM4ENPC1RAB9ASMN1; SMN2MAPT
Iodide SCHEMBL11648822 0.79 KDM4E (0.97) KDM4ENPC1RAB9ASMN1; SMN2MAPT
Iodide SCHEMBL11648817 0.79 KDM4E (0.97) KDM4ENPC1RAB9ASMN1; SMN2MAPT

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-5077408-A PROCESS FOR THE SYNTHESIS OF OXAZOLOPYRIDINE COMPOUNDS SCIENCE ET ORGANISATION (FR) 1991-12-31 US disclosed
US-5061713-A NO ANTIINFLAMMATORY ACTIVITY SCIENCE ET ORGANIZATION (FR) 1991-10-29 US disclosed