SCHEMBL31664526

SCHEMBL31664526

CCCCOCCCC(=O)N(C)C

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.68
TSHR P16473 2/20 0.46
CHRNB2 P17787 1/20 0.42
CHRNB4 P30926 1/20 0.42
CHRNA4 P43681 1/20 0.42
CYP3A4 P08684 1/20 0.41
CES2 O00748 1/20 0.39
DNM1 Q05193 1/20 0.38
ATM Q13315 1/20 0.38
MEN1 O00255 1/20 0.38
THRB P10828 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL31664494 0.94 ALDH1A1 (0.65) ALDH1A1TSHRCHRNB2CHRNB4CHRNA4
SCHEMBL31664510 0.92 ALDH1A1 (0.63) ALDH1A1CHRNB2CHRNB4CHRNA4CES2
SCHEMBL31664506 0.92 ALDH1A1 (0.61) ALDH1A1TSHRCHRNB2CHRNB4CHRNA4
SCHEMBL102640 0.92 ALDH1A1 (0.61) ALDH1A1TSHRCHRNB2CHRNB4CHRNA4
SCHEMBL27365691 0.88 ALDH1A1 (0.63) ALDH1A1TSHRCES2DNM1MEN1
SCHEMBL25339617 0.87 ALDH1A1 (0.60) ALDH1A1TSHRCHRNB2CHRNB4CHRNA4
SCHEMBL1374362 0.86 ALDH1A1 (0.59) ALDH1A1TSHRCHRNB2CHRNB4CHRNA4
SCHEMBL117693 0.84 ALDH1A1 (0.57) ALDH1A1CES2DNM1MEN1THRB
SCHEMBL22734125 0.84 ALDH1A1 (0.57) ALDH1A1CES2DNM1MEN1THRB
SCHEMBL22734126 0.84 ALDH1A1 (0.57) ALDH1A1CES2DNM1MEN1THRB

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
US-20250236812-A1 CLEANING AGENT COMPOSITION FOR SEMICONDUCTOR CLEANING, AND METHOD OF CLEANING SEMICONDUCTOR SUBSTRATE SHIN-ETSU CHEMICAL CO., LTD. (JP) 2025-07-24 US disclosed