SCHEMBL7879005

SCHEMBL7879005

CCC(c1ccccc1O)c1ccccc1C(c1ccccc1O)c1ccccc1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.57
GABRA1 P14867 1/20 0.47
GABRB2 P47870 1/20 0.47
POLB P06746 2/20 0.46
BCHE P06276 2/20 0.41
TYR P14679 2/20 0.41
ACHE P22303 2/20 0.41
LMNA P02545 4/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 2/20 0.38
ALOX15 P16050 2/20 0.38
GPR84 Q9NQS5 1/20 0.37
HKDC1 Q2TB90 1/20 0.37
HPGD P15428 4/20 0.36
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 2/20 0.35
CYP3A4 P08684 2/20 0.34
CYP1A2 P05177 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
SCHEMBL7809655 0.92 TSHR (0.65) TSHRGABRA1GABRB2POLBBCHE
SCHEMBL296591 0.90 TSHR (0.68) TSHRGABRA1GABRB2POLBBCHE
SCHEMBL29860994 0.90 TSHR (0.68) TSHRGABRA1GABRB2POLBBCHE
Ammonia Solution, Strong SCHEMBL28876892 0.88 TSHR (0.65) TSHRGABRA1GABRB2POLBBCHE
Bicarbonate SCHEMBL7033903 0.84 TSHR (0.61) TSHRGABRA1GABRB2POLBBCHE
SCHEMBL15639790 0.82 TSHR (0.64) TSHRGABRA1GABRB2POLBBCHE
SCHEMBL936321 0.82 TSHR (0.63) TSHRGABRA1GABRB2POLBBCHE
SCHEMBL1238318 0.82 TSHR (0.63) TSHRGABRA1GABRB2POLBBCHE
SCHEMBL4061536 0.81 GABRA1 (0.59) TSHRGABRA1GABRB2POLBLMNA
SCHEMBL11418774 0.81 TSHR (0.57) TSHRGABRA1GABRB2POLBBCHE

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
US-6316170-B2 COATING, EXPOSURE, DEVELOPMENT AND HEAT TREATMENT KABUSHIKI KAISHA TOSHIBA (JP) 2001-11-13 US disclosed