SCHEMBL28239087

SCHEMBL28239087

C(OCC1CO1)C1CO1.CCCc1cccc(O)c1-c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.37
MGLL Q99685 4/20 0.37
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 2/20 0.35
GLA P06280 1/20 0.35
ELANE P08246 1/20 0.34
CTSG P08311 1/20 0.34

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
SCHEMBL28047797 0.93 SMN1; SMN2 (0.39) TDP1MGLLSMN1; SMN2ALDH1A1ELANE
SCHEMBL28047888 0.90 MGLL (0.39) TDP1MGLLSMN1; SMN2ALDH1A1GLA
SCHEMBL28041231 0.85 HTR1A (0.44) TDP1SMN1; SMN2ALDH1A1GLA
SCHEMBL28047811 0.85 TDP1 (0.39) TDP1MGLLSMN1; SMN2ALDH1A1
SCHEMBL27313784 0.83 IAPP (0.46) TDP1SMN1; SMN2ALDH1A1ELANECTSG
SCHEMBL982273 0.82 ELANE (0.45) ELANECTSG
SCHEMBL17667190 0.81 SMN1; SMN2 (0.37) TDP1SMN1; SMN2ALDH1A1GLAELANE
SCHEMBL17667191 0.80 ALDH1A1 (0.52) TDP1MGLLSMN1; SMN2ALDH1A1GLA
SCHEMBL28239544 0.79 MEN1 (0.39) TDP1MGLLSMN1; SMN2ALDH1A1GLA
SCHEMBL2123587 0.78 SMN1; SMN2 (0.46) TDP1SMN1; SMN2ALDH1A1GLA

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-105246940-B Optical semiconductor sealing solidification compound 株式会社大赛璐 2018-09-04 CN disclosed