SCHEMBL24101306

SCHEMBL24101306

CNc1cc(Cl)ccc1C1Sc2ccccc2N1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.36
▸ THRB P10828 2/20 0.36
▸ ITGB2 P05107 1/20 0.34
▸ ICAM1 P05362 1/20 0.34
▸ ITGAL P20701 1/20 0.34
▸ DRD2 P14416 5/20 0.33
▸ HRH1 P35367 4/20 0.33
▸ CYP1A2 P05177 3/20 0.33
▸ CYP2D6 P10635 3/20 0.33
▸ DRD4 P21917 3/20 0.33
▸ HTR2C P28335 3/20 0.33
▸ CYP2C19 P33261 3/20 0.33
▸ TP53 P04637 3/20 0.33
▸ RAB9A P51151 3/20 0.33
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ LMNA P02545 2/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ HTR1A P08908 2/20 0.33
▸ NFKB1 P19838 2/20 0.33
▸ THPO P40225 2/20 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
SCHEMBL11886360 0.69 MAOA (0.37) HTR2CRAB9ASMN1; SMN2LMNASLC6A2
SCHEMBL17399090 0.68 MYLK (0.38) MAPTCYP1A2CYP2D6RAB9ASMN1; SMN2
SCHEMBL11886351 0.68 MAOA (0.33) MAPTTHRBRAB9ASMN1; SMN2KDM4E
SCHEMBL19061114 0.68 KDM4E (0.37) MAPTHTR2CRAB9ASMN1; SMN2HTR2B
SCHEMBL12193903 0.67 MAOA (0.41) TP53RAB9ASMN1; SMN2KDM4ENPC1
SCHEMBL30986852 0.67 MAOA (0.41) TP53RAB9ASMN1; SMN2KDM4ENPC1
SCHEMBL4626754 0.67 KDM4E (0.46) RAB9ASMN1; SMN2LMNATDP1KDM4E
SCHEMBL25953955 0.65 RAB9A (0.38) RAB9ASMN1; SMN2LMNAKDM4ENPC1
SCHEMBL2499677 0.64 GAA (0.50) MAPTCYP2C19SMN1; SMN2LMNAKDM4E
SCHEMBL27645758 0.64 BCHE (0.39) MAPTRAB9ASMN1; SMN2LMNATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021250358-A1 FLUORESCENT COMPOSITION COMPRISING AT LEAST ONE BENZAZOLE COMPOUND FOR THE SECUREMENT OF PRODUCTS Crime Science Technology (FR) 2021-12-16 — — WO disclosed
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