SCHEMBL15799989

SCHEMBL15799989

CCC1(COC(=O)c2ccc(O)cc2)COC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.54
ESR2 Q92731 2/20 0.54
CA12 O43570 2/20 0.54
CA1 P00915 2/20 0.54
CA2 P00918 2/20 0.54
CA7 P43166 2/20 0.54
CA9 Q16790 2/20 0.54
CA14 Q9ULX7 2/20 0.54
TSHR P16473 4/20 0.51
ALDH1A1 P00352 2/20 0.51
CHRM1 P11229 1/20 0.51
SLC6A2 P23975 1/20 0.51
KDR P35968 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
MAPK1 P28482 2/20 0.49
LMNA P02545 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C19 P33261 1/20 0.49

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
SCHEMBL686318 0.94 TSHR (0.50) ESR1ESR2CA12CA1CA2
SCHEMBL14839354 0.90 TSHR (0.47) ESR1ESR2CA12CA1CA2
SCHEMBL12959101 0.88 RAB9A (0.47) ESR1ESR2CA12CA1CA2
SCHEMBL16119470 0.88 MAPT (0.47) ESR1ESR2CA12CA1CA2
SCHEMBL14839401 0.87 TSHR (0.47) ESR1ESR2CA12CA1CA2
SCHEMBL9215046 0.87 TSHR (0.45) ESR1ESR2CA12CA1CA2
SCHEMBL14497538 0.87 TSHR (0.45) ESR1ESR2CA12CA1CA2
SCHEMBL17465564 0.87 POLB (0.46) ESR1ESR2CA12CA1CA2
SCHEMBL14491810 0.87 TSHR (0.48) ESR1TSHRALDH1A1CHRM1SLC6A2
SCHEMBL16077672 0.87 TSHR (0.55) ESR2CA1CA2TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8753795-B2 Photoresist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-06-17 US disclosed
US-8753795-B2 Photoresist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-06-17 US disclosed