SCHEMBL30898583

SCHEMBL30898583

CCn1c(C)c(C(c2ccc3c(c2)c2ccccc2n3CC)c2c(C)n(CC)c3ccccc23)c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.52
KDM4E B2RXH2 6/20 0.52
MEN1 O00255 5/20 0.52
KMT2A Q03164 5/20 0.52
HTT P42858 3/20 0.52
ALDH1A1 P00352 3/20 0.52
MAPK1 P28482 2/20 0.52
HPGD P15428 2/20 0.52
HBB P68871 1/20 0.52
HSD17B10 Q99714 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
SRC P12931 2/20 0.47
LMNA P02545 7/20 0.47
CYP19A1 P11511 1/20 0.46
POLB P06746 2/20 0.46
PKM P14618 1/20 0.46
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45

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
SCHEMBL254024 1.00 MAPT (0.52) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL253310 0.87 MAPT (0.63) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL10526623 0.85 CYP19A1 (0.46) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL9657076 0.84 CYP19A1 (0.52) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL7454319 0.84 CYP19A1 (0.48) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL30587346 0.84 CYP19A1 (0.48) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL9656956 0.84 CYP19A1 (0.45) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL9657046 0.83 ALDH1A1 (0.52) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL10529139 0.83 CYP19A1 (0.46) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL3156176 0.82 MAPT (0.58) MAPTKDM4EMEN1KMT2AHTT

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-4580592-A1 HAIR COLORING COMPOSITIONS L'OREAL (FR) 2025-07-09 EP disclosed
WO-2024050469-A1 HAIR COLORING COMPOSITIONS L'OREAL (FR) 2024-03-07 WO disclosed