SCHEMBL8036010

SCHEMBL8036010

CC(C)=CCOc1ccc(OCC=C(C)C)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 2/20 0.53
MTNR1A P48039 1/20 0.53
HTT P42858 1/20 0.49
GAA P10253 4/20 0.47
MAPT P10636 2/20 0.47
HPGD P15428 2/20 0.47
MEN1 O00255 1/20 0.47
NR1I2 O75469 1/20 0.47
LMNA P02545 1/20 0.47
PGR P06401 1/20 0.47
ADRB2 P07550 1/20 0.47
ADRB1 P08588 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
CNR1 P21554 1/20 0.47
TBXA2R P21731 1/20 0.47
SLC6A2 P23975 1/20 0.47
AGTR1 P30556 1/20 0.47
ADRA1A P35348 1/20 0.47
OPRD1 P41143 1/20 0.47

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
SCHEMBL4114408 0.93 KDM4E (0.49) KDM4EALDH1A1MTNR1AHTTGAA
SCHEMBL14012896 0.91 MAOB (0.52) KDM4EALDH1A1MTNR1AHTTGAA
SCHEMBL9727736 0.91 CYP19A1 (0.48) KDM4EALDH1A1MTNR1AGAAMGAM
SCHEMBL9856070 0.91 MGAM (0.55) KDM4EALDH1A1MTNR1AGAALMNA
SCHEMBL20024720 0.89 MAPT (0.55) KDM4EALDH1A1MTNR1AMAPTHPGD
SCHEMBL11555831 0.89 MAOB (0.53) KDM4EALDH1A1MTNR1AHTTGAA
SCHEMBL670129 0.89 PPARD (0.49) KDM4EALDH1A1MTNR1AHTTGAA
SCHEMBL9856624 0.89 KDM4E (0.46) KDM4EALDH1A1MTNR1AHTTGAA
SCHEMBL1135899 0.89 NDUFS8 (0.49) KDM4EALDH1A1MTNR1AMAPTHPGD
SCHEMBL9262789 0.88 ALDH1A1 (0.50) KDM4EALDH1A1MTNR1AHTTGAA

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-6010826-A Resist composition NIPPON ZEON CO., LTD. (JP) 2000-01-04 US disclosed
EP-0786701-A1 RESIST COMPOSITION NIPPON ZEON CO., LTD. (JP) 1997-07-30 EP disclosed