SCHEMBL9507123

SCHEMBL9507123

CCOC(C)(c1ccc(C)cc1)c1ccc(C)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.48
NPC1 O15118 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
ACHE P22303 3/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
KIF11 P52732 3/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA5A P35218 1/20 0.32
CA9 Q16790 1/20 0.32
AGXT P21549 2/20 0.32
BCHE P06276 1/20 0.32
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32

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
SCHEMBL10534242 0.82 TSHR (0.48) TSHRNPC1MAPTRAB9AACHE
SCHEMBL7614491 0.82 TSHR (0.48) TSHRNPC1MAPTRAB9AACHE
SCHEMBL661183 0.79 MAPK1 (0.46) TSHRACHEALDH1A1KIF11CYP3A4
Ammonia Solution, Strong SCHEMBL15899765 0.77 MAPK1 (0.44) TSHRACHEALDH1A1KIF11CYP3A4
SCHEMBL12139934 0.77 TSHR (0.43) TSHRNPC1MAPTRAB9AACHE
SCHEMBL7607879 0.76 TSHR (0.41) TSHRNPC1MAPTRAB9AACHE
SCHEMBL9504895 0.75 TSHR (0.57) TSHRNPC1MAPTRAB9AACHE
SCHEMBL9504874 0.73 TSHR (0.62) TSHRNPC1MAPTRAB9AACHE
SCHEMBL841033 0.72 TSHR (0.39) TSHRNPC1MAPTRAB9A
SCHEMBL19543320 0.72 KIF11 (0.47) KMT2AMEN1KIF11

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
EP-0261962-B1 PROCESS FOR PRODUCING PROPYLENE BLOCK COPOLYMER MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1993-07-28 EP disclosed
EP-0261962-A2 Process for producing propylene block copolymer MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1988-03-30 EP disclosed