SCHEMBL8155495

SCHEMBL8155495

CCOC(=O)C(Cl)CC.CCOC(=O)CC(C)Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.42
CYP3A4 P08684 2/20 0.42
ALOX15 P16050 2/20 0.42
TSHR P16473 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
HSD17B10 Q99714 2/20 0.41
CHRM1 P11229 1/20 0.41
ADORA1 P30542 1/20 0.41
MGAM O43451 1/20 0.40
GAA P10253 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
TRPA1 O75762 1/20 0.38
KDM4E B2RXH2 2/20 0.35
CYP2D6 P10635 1/20 0.35
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
CYP1A2 P05177 1/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 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
SCHEMBL10573171 0.88
SCHEMBL2997479 0.88
SCHEMBL30829428 0.84
SCHEMBL5613333 0.84
SCHEMBL10571663 0.84
SCHEMBL8308112 0.82 ALDH1A1 (0.53) ALDH1A1CYP3A4ALOX15TSHRTDP1
SCHEMBL6809972 0.82 ALDH1A1 (0.53) ALDH1A1CYP3A4ALOX15TSHRTDP1
SCHEMBL6806491 0.82 ALDH1A1 (0.53) ALDH1A1CYP3A4ALOX15TSHRTDP1
SCHEMBL11148340 0.82 ALDH1A1 (0.43) ALDH1A1CYP3A4ALOX15TSHRTDP1
SCHEMBL21811591 0.75 PRKCA (0.34) ALDH1A1TDP1MGAMGAASI

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-6041157-A Environmentally sensitive compositions of matter based on 3H-fluoren-3-ylidenes and process for making same GOETZ FREDERICK JAMES (US) 2000-03-21 US disclosed