SCHEMBL28053368

SCHEMBL28053368

CCCCCCC1(CCCCCC)C=CCC1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
THRB P10828 1/20 0.33
OPRM1 P35372 1/20 0.30
OPRD1 P41143 1/20 0.30
OPRK1 P41145 1/20 0.30
OPRL1 P41146 1/20 0.30

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
SCHEMBL27962115 0.88 MMP2 (0.33) TSHRTHRB
SCHEMBL27709201 0.79 OPRM1 (0.31) OPRM1OPRL1
SCHEMBL28097242 0.69 TSHR (0.32) TSHRTHRB
SCHEMBL28273050 0.67 TSHR (0.37) TSHRTHRB
SCHEMBL5339781 0.66 TSHR (0.42) TSHRTHRBOPRM1OPRD1OPRK1
SCHEMBL9763148 0.66 TSHR (0.42) TSHRTHRBOPRM1OPRD1OPRK1
SCHEMBL9763110 0.66 TSHR (0.42) TSHRTHRBOPRM1OPRD1OPRK1
SCHEMBL5349789 0.66 TSHR (0.42) TSHRTHRBOPRM1OPRD1OPRK1
SCHEMBL9761933 0.66 TSHR (0.42) TSHRTHRBOPRM1OPRD1OPRK1
SCHEMBL5344705 0.66 TSHR (0.42) TSHRTHRBOPRM1OPRD1OPRK1

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-105237749-A Conjugated polymer semiconductor material, and preparation method and application thereof UNIV SOOCHOW 2016-01-13 CN disclosed