SCHEMBL28511142

SCHEMBL28511142

C=Cc1sccc1OCCCCCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
NR1I2 O75469 1/20 0.38
LMNA P02545 1/20 0.38
CHRM2 P08172 1/20 0.38
CYP3A4 P08684 1/20 0.38
ADRA2A P08913 1/20 0.38
MAPT P10636 1/20 0.38
OPRK1 P41145 1/20 0.38
HTR2B P41595 1/20 0.38
SLC6A3 Q01959 1/20 0.38
KMT2A Q03164 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
NR5A1 Q13285 1/20 0.38
SMPD1 P17405 1/20 0.37
ESR1 P03372 2/20 0.36
PPARG P37231 1/20 0.36
MCHR1 Q99705 1/20 0.35
TLR8 Q9NR97 1/20 0.35
CHUK O15111 1/20 0.35
DAPK3 O43293 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
SCHEMBL27792891 0.84 MEN1 (0.41) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL11713104 0.84 MEN1 (0.41) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL1871186 0.84 MEN1 (0.41) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL11713106 0.84 MEN1 (0.41) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL5133914 0.78 NR5A1 (0.43) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL3103832 0.78 NR5A1 (0.43) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL1279017 0.78 NR5A1 (0.43) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL29170841 0.76 NR5A1 (0.42) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL9511395 0.76 NR5A1 (0.42) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL9641044 0.76 NR5A1 (0.42) MEN1NR1I2LMNACHRM2CYP3A4

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
CN-112375213-A Novel conductive polymer and preparation method and application thereof 中国科学院上海微系统与信息技术研究所 2021-02-19 CN disclosed