SCHEMBL11275412

SCHEMBL11275412

O=C(Cl)c1cc(=O)c(-c2ccccc2)co1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
SMN1; SMN2 Q16637 5/20 0.41
NPC1 O15118 5/20 0.41
RAB9A P51151 4/20 0.41
POLB P06746 4/20 0.41
KDM4E B2RXH2 4/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MAPT P10636 4/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
ALOX15 P16050 2/20 0.40
ALOX12 P18054 2/20 0.40
USP2 O75604 2/20 0.40
TP53 P04637 2/20 0.40
CYP3A4 P08684 2/20 0.40
HPGD P15428 2/20 0.40
BRCA1 P38398 1/20 0.40
BLM P54132 1/20 0.40
HSD17B10 Q99714 1/20 0.40
HDAC6 Q9UBN7 2/20 0.39

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
SCHEMBL11262923 0.86 PTGER4 (0.48) ALDH1A1SMN1; SMN2NPC1RAB9APOLB
Hydrochloric Acid SCHEMBL11275414 0.85 PTGER4 (0.47) ALDH1A1SMN1; SMN2NPC1RAB9APOLB
SCHEMBL11265765 0.83 BCAT2 (0.44) ALDH1A1SMN1; SMN2NPC1RAB9APOLB
SCHEMBL11264741 0.80 FGFR1 (0.43) ALDH1A1SMN1; SMN2NPC1RAB9APOLB
SCHEMBL11269530 0.76 MAPT (0.46) ALDH1A1SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL3569466 0.72 DAO (0.56) ALDH1A1SMN1; SMN2NPC1RAB9APOLB
SCHEMBL11281901 0.69 NR4A2 (0.52) ALDH1A1SMN1; SMN2NPC1RAB9APOLB
SCHEMBL2442343 0.69 GSTP1 (0.62) ALDH1A1SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL11263331 0.68 ATM (0.41) ALDH1A1SMN1; SMN2NPC1RAB9APOLB
SCHEMBL9787560 0.67 ELANE (0.38) ALDH1A1SMN1; SMN2RAB9APOLBKDM4E

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-4364956-A ASTHMA LILLY INDUSTRIES LIMITED (GB) 1982-12-21 US disclosed