SCHEMBL27559698

SCHEMBL27559698

CCCCSNc1ccc(N)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.38
ALDH1A1 P00352 6/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CYP3A4 P08684 4/20 0.36
TSHR P16473 3/20 0.36
RAB9A P51151 3/20 0.36
TDP1 Q9NUW8 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MAPK1 P28482 2/20 0.36
PSMD14 O00487 1/20 0.36
RECQL P46063 1/20 0.36
GFER P55789 1/20 0.36
LMNA P02545 2/20 0.36
CYP1A2 P05177 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
PDE4D Q08499 1/20 0.35
NPC1 O15118 2/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 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
SCHEMBL11409406 0.88 MAPT (0.39) MAPTALDH1A1CYP3A4TSHRRAB9A
SCHEMBL8948248 0.76 MAPT (0.43) MAPTALDH1A1CYP3A4TSHRRAB9A
SCHEMBL8525111 0.74 ALDH1A1 (0.46) ALDH1A1NPSR1RAB9ANPC1HTT
SCHEMBL12826355 0.70 CA1 (0.54) ALDH1A1CYP3A4TSHRTDP1L3MBTL1
SCHEMBL8445226 0.70 MTNR1A (0.45) MAPTALDH1A1TSHRRAB9ATDP1
SCHEMBL422539 0.69 MAOA (0.58) MAPTALDH1A1CYP3A4TSHRRAB9A
SCHEMBL791177 0.69 APP (0.46) MAPTALDH1A1CYP3A4RAB9AMAPK1
SCHEMBL175664 0.68 ABL1 (0.49) MAPTALDH1A1TLR8
SCHEMBL21480319 0.68 MAPT (0.46) MAPTALDH1A1CYP3A4TSHRRAB9A
SCHEMBL20408817 0.67 EPHX2 (0.35) CYP3A4CYP2C9CYP2C19

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
CN-1372458-A Oxidation dyeing composition for keratinous fibres and dyeing method using said composition OREAL (FR) 2002-10-02 CN disclosed
CN-1372457-A Oxidation dyeing composition for kevatinous fibers and dyeing method using same OREAL (FR) 2002-10-02 CN disclosed