SCHEMBL31664534

SCHEMBL31664534

CCCOCCCC(=O)N(CCC)CCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
HPGD P15428 2/20 0.50
LMNA P02545 2/20 0.43
CA12 O43570 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
NPC1 O15118 3/20 0.36
TSHR P16473 5/20 0.36
MAPK1 P28482 2/20 0.36
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
NR1I2 O75469 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CYP3A4 P08684 1/20 0.34
ZDHHC20 Q5W0Z9 1/20 0.34

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
SCHEMBL31664508 0.92 ALDH1A1 (0.50) ALDH1A1HPGDLMNACA12CA2
SCHEMBL31664507 0.91 MMP1 (0.44) ALDH1A1HPGDLMNACA12CA9
SCHEMBL31664504 0.91 ALDH1A1 (0.48) ALDH1A1HPGDLMNATSHRSIGMAR1
SCHEMBL31664529 0.90 ALDH1A1 (0.52) ALDH1A1HPGDLMNACA12CA2
SCHEMBL31664498 0.89 CES2 (0.47) ALDH1A1HPGDLMNAZDHHC20CES2
SCHEMBL31664525 0.89 LMNA (0.41) ALDH1A1HPGDLMNACA12CA9
SCHEMBL1373468 0.88 ALDH1A1 (0.53) ALDH1A1HPGDLMNACA12CA2
SCHEMBL31664541 0.86 LMNA (0.61) ALDH1A1HPGDLMNACA12CA9
SCHEMBL31664509 0.85 MMP1 (0.46) ALDH1A1HPGDLMNACA12CA9
SCHEMBL1376984 0.85 ALDH1A1 (0.50) ALDH1A1HPGDLMNACA12CA2

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