SCHEMBL28846306

SCHEMBL28846306

CCCCC1(c2ccccc2)C=CC=C(C)C1C

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 3/20 0.35
OPRL1 P41146 3/20 0.35
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
ELANE P08246 1/20 0.31
BCHE P06276 1/20 0.30
ACHE P22303 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
SCHEMBL28012995 0.84
SCHEMBL2423528 0.72 OPRM1 (0.36) OPRM1OPRL1MMP2MMP3MMP9
SCHEMBL28662546 0.69 CHRNB2 (0.33)
SCHEMBL6547131 0.68 OPRM1 (0.31) OPRM1OPRL1MMP2MMP3MMP9
SCHEMBL6548185 0.66 KDM1A (0.33)
SCHEMBL6546814 0.64
SCHEMBL12656180 0.63 OPRM1 (0.41) OPRM1OPRL1MMP2MMP3MMP9
SCHEMBL10640077 0.62 KDM1A (0.32)
SCHEMBL6546732 0.61 KDM4E (0.31)
SCHEMBL14778502 0.60 OPRM1 (0.43) OPRM1OPRL1MMP2MMP3MMP9

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-104080880-B For the ionic liquid cooled down in hot environment 普罗伊奥尼克有限公司 2017-07-25 CN disclosed