SCHEMBL28292778

SCHEMBL28292778

Cc1ccccc1C(C)Sc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.43
TSHR P16473 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MAPK1 P28482 1/20 0.40
ACP3 P15309 1/20 0.38
ACHE P22303 1/20 0.36
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
ALDH1A1 P00352 3/20 0.34
ALOX15 P16050 1/20 0.34
CYP2D6 P10635 2/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
MGLL Q99685 1/20 0.33
HSD17B10 Q99714 1/20 0.33
SLC22A2 O15244 1/20 0.33
SLC22A1 O15245 1/20 0.33
GRIN2D O15399 1/20 0.33

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
SCHEMBL6011687 0.78 ESR1 (0.50) ESR1TSHRACP3ACHEALDH1A1
SCHEMBL10662615 0.75 ALDH1A1 (0.47) ALDH1A1ADRA2AADRA2BSLC6A4CYP2C19
SCHEMBL15141737 0.73 ALDH1A1 (0.41) SMN1; SMN2L3MBTL1ACP3ALDH1A1LMNA
SCHEMBL2025569 0.73 ESR1 (0.35) ESR1TSHRSMN1; SMN2L3MBTL1ACP3
SCHEMBL9475604 0.73 ALDH1A1 (0.35) TSHRSMN1; SMN2L3MBTL1MAPK1MAOA
SCHEMBL11370239 0.73 L3MBTL1 (0.50) SMN1; SMN2L3MBTL1MAOAMAOBALDH1A1
SCHEMBL678366 0.70 ESR1 (0.52) ESR1TSHRACP3ACHEALDH1A1
Hydrogen Peroxide SCHEMBL10348374 0.70 GABRA1 (0.54) ESR1TSHRACP3ACHEALDH1A1
SCHEMBL20752897 0.70 HNF4A (0.41) TSHRSMN1; SMN2L3MBTL1MAPK1ALDH1A1
SCHEMBL343269 0.69 SMN1; SMN2 (0.45) SMN1; SMN2L3MBTL1MAPK1MAOAMAOB

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-109661601-A Polarization plates and its manufacturing method 住友化学株式会社 2019-04-19 CN disclosed