SCHEMBL7848138

SCHEMBL7848138

CC(C)(C)c1ccc(C=C2CC3CC(C2=O)C3(C)C)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP1A2 P05177 2/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
HTT P42858 2/20 0.35
MAPT P10636 3/20 0.33
MAPK1 P28482 3/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ADAMTS5 Q9UNA0 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
TP53 P04637 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSP90AA1 P07900 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
SCHEMBL7839983 0.81 DYRK1A (0.49) CYP1A2MEN1KMT2AMAPTCYP3A4
SCHEMBL7848264 0.72 ALDH1A1 (0.72) ALDH1A1KDM4ECYP1A2MEN1KMT2A
SCHEMBL21440929 0.71 TSHR (0.33) MAPK1
SCHEMBL7840041 0.69 ALDH1A1 (0.57) ALDH1A1KDM4ECYP1A2MEN1KMT2A
SCHEMBL24827704 0.69 MAPT (0.61) ALDH1A1KDM4ECYP1A2MEN1KMT2A
SCHEMBL7848714 0.68 MAOA (0.39) KDM4EMEN1KMT2AMAPTNPC1
SCHEMBL28266343 0.64 MAPT (0.61) ALDH1A1CYP1A2MEN1KMT2AHTT
SCHEMBL31373106 0.64 AKR1C3 (0.62) ALDH1A1CYP1A2MEN1KMT2AHTT
SCHEMBL28266341 0.64 MAPT (0.61) ALDH1A1CYP1A2MEN1KMT2AHTT
SCHEMBL7839741 0.64 MEN1 (0.38) ALDH1A1KDM4ECYP1A2MEN1KMT2A

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-0754445-B1 Photostable cosmetic light screening compositions HOFFMANN LA ROCHE (CH) 2001-10-24 EP claimed
US-5840282-A SUNSCREEN AGENTS; BENZYLIDENE-TYPE STABILIZER GIVAUDAN-ROURE (INTERNATIONAL) SA (CH) 1998-11-24 US claimed