SCHEMBL9872532

SCHEMBL9872532

CC(C)(C)c1cc(-n2nc3ccccc3n2)c(OC(=O)Cc2cccc3ccccc23)c(C(C)(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.43
TDP1 Q9NUW8 2/20 0.43
PKM P14618 2/20 0.42
SIRT5 Q9NXA8 1/20 0.42
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
HPGD P15428 1/20 0.40
VNN1 O95497 1/20 0.37
HIF1A Q16665 1/20 0.36
LMNA P02545 2/20 0.35
ATM Q13315 2/20 0.35
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
GSK3B P49841 1/20 0.35
ALDH1A1 P00352 2/20 0.35
HTT P42858 1/20 0.35
KDM4E B2RXH2 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL9870748 0.81 VCAM1 (0.40) L3MBTL1TDP1HPGDLMNAALDH1A1
Naphthalene SCHEMBL9872543 0.80 RAB9A (0.47) L3MBTL1TDP1KMT2AMEN1HPGD
SCHEMBL9872313 0.79 NPC1 (0.50) L3MBTL1TDP1HPGDLMNAALDH1A1
SCHEMBL10593219 0.77 VCAM1 (0.39) L3MBTL1TDP1KMT2AMEN1HPGD
SCHEMBL5417312 0.75 NPC1 (0.41) L3MBTL1TDP1HPGDLMNAATM
SCHEMBL28022693 0.74 NPC1 (0.38) L3MBTL1TDP1HPGDLMNAALDH1A1
SCHEMBL9871470 0.73 RXRA (0.36) L3MBTL1TDP1KMT2AHPGDLMNA
SCHEMBL3537498 0.73 HTT (0.40) HPGDLMNAALDH1A1HTTKDM4E
SCHEMBL574766 0.70 NPC1 (0.39) L3MBTL1TDP1KMT2AHPGDATM
SCHEMBL9870023 0.70 NPC1 (0.55) L3MBTL1TDP1KMT2AMEN1HPGD

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5030731-A Substituted benzotriazoles; storage stability; lacquers CIBA-GEIGY CORPORATION (US) 1991-07-09 US disclosed
EP-0180548-B1 COATINGS STABILIZED AGAINST THE ACTION OF LIGHT CIBA-GEIGY AG (CH) 1989-06-28 EP disclosed
US-4775707-A BLOCKED BENZOTRIAZOLES CIBA-GEIGY CORPORATION (US) 1988-10-04 US disclosed
EP-0180548-A2 Coatings stabilized against the action of light CIBA-GEIGY AG (CH) 1986-05-07 EP disclosed