SCHEMBL4655283

SCHEMBL4655283

CCCCC(C1CCCC1)C1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.42
SHBG P04278 1/20 0.42
CYP1A2 P05177 2/20 0.41
METAP1 P53582 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
DNM1 Q05193 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
MMP1 P03956 1/20 0.33
MMP7 P09237 1/20 0.33
MMP12 P39900 1/20 0.33
ECE1 P42892 1/20 0.33
MMP13 P45452 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
CYP2D6 P10635 1/20 0.33
TSHR P16473 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
SCHEMBL9297316 0.98 EPHX1 (0.46) EPHX1SHBGCYP1A2METAP1SIGMAR1
SCHEMBL5824287 0.91 EPHX1 (0.44) EPHX1SHBGCYP1A2SIGMAR1TSHR
SCHEMBL28026127 0.91 EPHX1 (0.39) EPHX1SHBGCYP1A2SIGMAR1DNM1
SCHEMBL4655240 0.90 DNM1 (0.38) SHBGCYP1A2METAP1DNM1ALDH1A1
SCHEMBL11440474 0.89 EPHX1 (0.43) EPHX1SHBGCYP1A2SIGMAR1TSHR
SCHEMBL2593250 0.89 EPHX1 (0.43) EPHX1SHBGCYP1A2SIGMAR1TSHR
SCHEMBL11440912 0.89 EPHX1 (0.43) EPHX1SHBGCYP1A2SIGMAR1TSHR
SCHEMBL16319347 0.89 EPHX1 (0.43) EPHX1SHBGCYP1A2SIGMAR1TSHR
SCHEMBL10929841 0.89 EPHX1 (0.43) EPHX1SHBGCYP1A2SIGMAR1TSHR
SCHEMBL16110550 0.89 EPHX1 (0.43) EPHX1SHBGCYP1A2SIGMAR1TSHR

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-1986598-A1 UV FILTER CAPSULES COMPRISING AN AMINOSUBSTITUTED HYDROXYBENZOPHENONE Merck Patent GmbH (DE) 2008-11-05 EP disclosed
WO-2007093252-A1 UV FILTER CAPSULES COMPRISING AN AMINOSUBSTITUTED HYDROXYBENZOPHENONE MERCK PATENT GMBH (DE) 2007-08-23 WO disclosed