SCHEMBL7368285

SCHEMBL7368285

COc1ccccc1CCC(C(=O)O)C1CC1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGFR P43088 1/20 0.45
MTNR1A P48039 1/20 0.43
MTNR1B P49286 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.41
GRIN2B Q13224 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
KDM1A O60341 2/20 0.40
MAOA P21397 2/20 0.40
SIGMAR1 Q99720 2/20 0.40
MAOB P27338 1/20 0.40

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
SCHEMBL7369261 0.89 ALDH1A1 (0.41) MEN1KMT2A
SCHEMBL7365439 0.86 HRH1 (0.43)
SCHEMBL7362412 0.84 HSD17B10 (0.48) MTNR1AMTNR1BTAAR1MEN1KMT2A
SCHEMBL7367030 0.83 PTGER1 (0.42) PTGFRTAAR1MEN1KMT2A
SCHEMBL7363860 0.81 PTGER1 (0.42) PTGFRTAAR1KDM1AMAOAMAOB
SCHEMBL7363028 0.81 SLC6A2 (0.41) SMN1; SMN2TAAR1MEN1KMT2AKDM1A
SCHEMBL7360786 0.80 LDHA (0.47) PTGFRSMN1; SMN2MEN1KMT2A
SCHEMBL7368270 0.79 GRM2 (0.52) MTNR1ASMN1; SMN2KMT2A
SCHEMBL7362960 0.78 GRM2 (0.55) PTGFRMTNR1AMTNR1BSMN1; SMN2TAAR1
SCHEMBL7366774 0.78 GRM2 (0.48) PTGFRSMN1; SMN2TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0771196-A4 EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS LILLY CO ELI (US) 1997-09-03 EP disclosed
EP-0771196-A1 EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1997-05-07 EP disclosed
WO-1996007405-A1 EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1996-03-14 WO disclosed