SCHEMBL28673201

SCHEMBL28673201

CCC(=O)c1cc(Br)ccc1OC(CF)COCc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 1/20 0.40
LRRK2 Q5S007 11/20 0.39
HPGD P15428 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
POLB P06746 2/20 0.37
LMNA P02545 2/20 0.37
PTGES O14684 1/20 0.36
USP2 O75604 1/20 0.36
CCR5 P51681 1/20 0.35

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
SCHEMBL29368013 1.00 PTGER1 (0.40) PTGER1LRRK2HPGDKDM4EALDH1A1
SCHEMBL22823736 1.00 PTGER1 (0.40) PTGER1LRRK2HPGDKDM4EALDH1A1
SCHEMBL29368644 0.89 PTGDR2 (0.46) PTGER1LRRK2HPGDKDM4EALDH1A1
SCHEMBL22824019 0.89 PTGDR2 (0.46) PTGER1LRRK2HPGDKDM4EALDH1A1
SCHEMBL29602289 0.89 PTGDR2 (0.46) PTGER1LRRK2HPGDKDM4EALDH1A1
SCHEMBL22823743 0.85 SMN1; SMN2 (0.35) HPGDALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL28672381 0.85 SMN1; SMN2 (0.35) HPGDALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL29368299 0.85 SMN1; SMN2 (0.35) HPGDALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL22823975 0.81 PPARA (0.37) HPGDKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL29369333 0.81 PPARA (0.37) HPGDKDM4ENPC1RAB9ASMN1; 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
EP-3986852-A1 COMPOUNDS FOR THE TREATMENT OF NEUROMUSCULAR DISORDERS NMD Pharma A/S (DK) 2022-04-27 EP disclosed
CN-114008012-A Compounds for the treatment of neuromuscular disorders NMD制药股份公司 2022-02-01 CN disclosed