SCHEMBL31664537

SCHEMBL31664537

CCCCCOCCC(=O)N(CCCC)CCCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.44
MMP1 P03956 1/20 0.44
MMP2 P08253 1/20 0.44
MMP3 P08254 1/20 0.44
MMP8 P22894 1/20 0.44
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA9 Q16790 2/20 0.42
MEN1 O00255 1/20 0.42
THRB P10828 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
MAPT P10636 1/20 0.42
ZDHHC20 Q5W0Z9 1/20 0.42
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
DNM1 Q05193 1/20 0.39
ADRB2 P07550 1/20 0.38
LMNA P02545 1/20 0.38
TSHR P16473 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
SCHEMBL31664492 0.98 CES2 (0.47) CES2MMP1MMP2MMP3MMP8
SCHEMBL31664497 0.96 CES2 (0.44) CES2MMP1MMP2MMP3MMP8
SCHEMBL31664495 0.95 CES2 (0.47) CES2CA12CA1CA9MEN1
SCHEMBL15452893 0.94 MMP1 (0.46) CES2MMP1MMP2MMP3MMP8
SCHEMBL31664503 0.93 TSHR (0.42) CES2MMP1MMP2MMP3MMP8
SCHEMBL1373604 0.93 ALDH1A1 (0.48) CES2MEN1THRBHTTKMT2A
SCHEMBL31664522 0.93 CES2 (0.44) CES2MMP1MMP2MMP3MMP8
SCHEMBL31664551 0.91 CES2 (0.47) CES2MMP1MMP2MMP3MMP8
SCHEMBL1375414 0.91 CES2 (0.47) CES2MEN1THRBHTTKMT2A
SCHEMBL15611668 0.91 MMP1 (0.46) MMP1MMP2MMP3MMP8CA12

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