SCHEMBL29997376

SCHEMBL29997376

CCCCCCCCc1cc2ccc3cc4c(ccc5cc(CCCCCCCC)sc54)cc3c2s1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
KCNH2 Q12809 1/20 0.37
CTSV O60911 1/20 0.34
CTSL P07711 1/20 0.34
ESR1 P03372 2/20 0.33
TP53 P04637 2/20 0.33
CYP3A4 P08684 2/20 0.33
ADRA2A P08913 2/20 0.33
ADORA3 P0DMS8 2/20 0.33
TACR2 P21452 2/20 0.33
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33
SLC6A3 Q01959 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
SHBG P04278 1/20 0.33
HSPD1 P10809 1/20 0.33
ADRB3 P13945 1/20 0.33
HTR2C P28335 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
SCHEMBL25175232 1.00 MAPT (0.40) MAPTKCNH2CTSVCTSLESR1
SCHEMBL2367972 0.92 MAPT (0.38) MAPTKCNH2CTSVCTSLESR1
SCHEMBL31019869 0.91 MAPT (0.35) MAPTKCNH2CTSVCTSLHSD17B10
SCHEMBL31019905 0.90 GPR35 (0.38) MAPTKCNH2
SCHEMBL12279305 0.90 MAPT (0.37) MAPTKCNH2CTSVCTSLESR1
SCHEMBL12278593 0.90 MAPT (0.37) MAPTKCNH2CTSVCTSLESR1
SCHEMBL15532618 0.90 MAPT (0.37) MAPTKCNH2CTSVCTSLESR1
SCHEMBL12278337 0.90 MAPT (0.37) MAPTKCNH2CTSVCTSLESR1
SCHEMBL12278344 0.90 MAPT (0.37) MAPTKCNH2CTSVCTSLESR1
SCHEMBL12279004 0.90 MAPT (0.37) MAPTKCNH2CTSVCTSLESR1

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-115210239-B Aromatic compound, organic semiconductor layer, and organic thin film transistor 东曹株式会社 2025-04-11 CN disclosed
CN-115210239-A Aromatic compound, organic semiconductor layer and organic thin film transistor 东曹株式会社 2022-10-18 CN disclosed