SCHEMBL28192121

SCHEMBL28192121

CCC1CC(O)CCC1c1cccc(C(c2cccc(C3CCC(O)CC3CC)c2)c2ccccc2O)c1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.38
▸ CNR2 P34972 1/20 0.38
▸ HTR2A P28223 2/20 0.35
▸ HTR2C P28335 2/20 0.35
▸ HTR2B P41595 2/20 0.35
▸ FFAR1 O14842 6/20 0.33
▸ TSHR P16473 1/20 0.33
▸ CHRNB4 P30926 1/20 0.32
▸ CHRNA3 P32297 1/20 0.32
▸ DRD2 P14416 2/20 0.30
▸ SLC6A4 P31645 1/20 0.30
▸ SLC6A3 Q01959 1/20 0.30
▸ DRD3 P35462 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
SCHEMBL27771370 0.76 SLC5A2 (0.41) CNR1CNR2HTR2AHTR2CHTR2B
SCHEMBL28192161 0.71 HDAC4 (0.33) FFAR1
SCHEMBL30454358 0.63 GABRA1 (0.43) HTR2AHTR2BTSHRSLC6A3DRD3
SCHEMBL29027318 0.63 GABRA1 (0.43) HTR2AHTR2BTSHRSLC6A3DRD3
SCHEMBL2292650 0.62 TRPA1 (0.32) CNR1CNR2FFAR1
SCHEMBL10957120 0.61 TYR (0.43) HTR2AHTR2BTSHRSLC6A3DRD3
SCHEMBL982045 0.61 GABRA1 (0.52) TSHRSLC6A4SLC6A3
SCHEMBL23995536 0.60 HTR2C (0.68) HTR2AHTR2CHTR2BSLC6A4SLC6A3
SCHEMBL22335081 0.60 HTR2C (0.68) HTR2AHTR2CHTR2BDRD2SLC6A4
SCHEMBL22335135 0.60 HTR2C (0.70) HTR2AHTR2CHTR2BDRD2SLC6A4

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-107544209-A Positive photosensitive resin composition and use thereof 奇美实业股份有限公司 2018-01-05 — — CN disclosed
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