SCHEMBL28845249

SCHEMBL28845249

c1ccc(COCC2(OCc3ccccc3)CCCCO2)cc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 6/20 0.41
TSHR P16473 1/20 0.40
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33
OPRL1 P41146 1/20 0.33
LTA4H P09960 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 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
SCHEMBL31680308 0.84 ALDH1A1 (0.34) TSHROPRM1OPRD1OPRK1OPRL1
SCHEMBL17610576 0.78 TACR1 (0.42) TACR1TSHROPRM1MEN1KMT2A
SCHEMBL714091 0.74 TSHR (0.48) TACR1TSHRLTA4HMEN1KMT2A
SCHEMBL10728607 0.74 TSHR (0.35) TSHROPRM1OPRD1OPRK1OPRL1
SCHEMBL27973569 0.73 ALDH1A1 (0.38) TSHROPRM1OPRD1OPRK1OPRL1
SCHEMBL28773272 0.73 TMEM97 (0.38) TACR1TSHROPRM1
SCHEMBL29112123 0.73 TACR1 (0.43) TACR1TSHROPRM1LTA4HMEN1
SCHEMBL11355291 0.73 TACR1 (0.43) TACR1TSHRLTA4HMEN1KMT2A
SCHEMBL21082398 0.73 TACR1 (0.43) TACR1TSHRLTA4HMEN1KMT2A
SCHEMBL28176655 0.73 TACR1 (0.43) TACR1TSHRLTA4HMEN1KMT2A

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
CN-115066438-A ASGPR binding compounds for degrading extracellular proteins 阿维拉治疗公司 2022-09-16 CN disclosed