SCHEMBL17667237

SCHEMBL17667237

C(OCC1CO1)C1CO1.CCCCc1ccccc1-c1ccccc1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
ELANE P08246 2/20 0.36
CTSG P08311 2/20 0.36
TSHR P16473 1/20 0.36
GLA P06280 1/20 0.35
BID P55957 3/20 0.35
MCL1 Q07820 3/20 0.35
BCL2L1 Q07817 2/20 0.35
BAK1 Q16611 2/20 0.35
KAT8 Q9H7Z6 2/20 0.35
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
EP300 Q09472 1/20 0.35
KAT2A Q92830 1/20 0.35
KAT2B Q92831 1/20 0.35
KAT5 Q92993 1/20 0.35
SAE1 Q9UBE0 1/20 0.35
TYR P14679 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
SCHEMBL17667190 0.92 SMN1; SMN2 (0.37) SMN1; SMN2ALDH1A1TDP1ELANECTSG
SCHEMBL2123587 0.89 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1TDP1TSHRGLA
SCHEMBL17667216 0.87 ALDH1A1 (0.39) SMN1; SMN2ALDH1A1TDP1TSHRGLA
SCHEMBL9350609 0.84 TDP1 (0.49) SMN1; SMN2ALDH1A1TDP1TSHRBID
SCHEMBL8750967 0.84 TDP1 (0.49) SMN1; SMN2ALDH1A1TDP1TSHRBID
SCHEMBL413662 0.84 TDP1 (0.49) SMN1; SMN2ALDH1A1TDP1TSHRBID
SCHEMBL29256323 0.84 TDP1 (0.49) SMN1; SMN2ALDH1A1TDP1TSHRBID
SCHEMBL1003516 0.84 TDP1 (0.49) SMN1; SMN2ALDH1A1TDP1TSHRBID
SCHEMBL21552431 0.84 TDP1 (0.49) SMN1; SMN2ALDH1A1TDP1TSHRBID
SCHEMBL394006 0.83 TDP1 (0.47) SMN1; SMN2ALDH1A1TDP1TSHRGLA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9685597-B2 Curable composition for sealing optical semiconductor DAICEL CORPORATION (JP) 2017-06-20 US disclosed
US-20160126431-A1 CURABLE COMPOSITION FOR SEALING OPTICAL SEMICONDUCTOR DAICEL CORPORATION (JP) 2016-05-05 US disclosed
EP-3006481-A1 CURABLE COMPOSITION FOR SEALING OPTICAL SEMICONDUCTOR Daicel Corporation (JP) 2016-04-13 EP disclosed