SCHEMBL7523921

SCHEMBL7523921

C=C(C)C(=O)OC(CCC)Oc1ccccc1.C=C(C)C(=O)OC1(CC)CCCC1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSK P43235 6/20 0.35
CTSL P07711 4/20 0.35
CTSB P07858 3/20 0.35
ELANE P08246 1/20 0.33
PPARG P37231 2/20 0.32
PPARA Q07869 2/20 0.32
APOBEC3A P31941 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
CTSS P25774 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TSHR P16473 1/20 0.31
MTNR1A P48039 1/20 0.31
MTNR1B P49286 1/20 0.31
MME P08473 2/20 0.31
HDAC4 P56524 1/20 0.30

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
SCHEMBL7252803 0.90 CTSL (0.32) CTSKCTSLCTSB
SCHEMBL7521250 0.87 APOBEC3A (0.36) CTSKCTSLCTSBELANEAPOBEC3A
SCHEMBL7528998 0.77 CTSK (0.41) CTSKCTSLCTSBELANEPPARG
SCHEMBL7251880 0.77 KDM4E (0.30) APOBEC3AAPOBEC3G
SCHEMBL1404301 0.75 MTNR1A (0.42) ELANEPPARGPPARATSHRMTNR1A
SCHEMBL47303 0.74 ALDH1A1 (0.37) TSHR
SCHEMBL13908015 0.74 KMT2A (0.38) ELANEPPARGPPARAMEN1KMT2A
SCHEMBL133202 0.73 ALDH1A1 (0.35) TSHR
SCHEMBL686077 0.73 ALDH1A1 (0.35) TSHR
SCHEMBL4544316 0.73 ALDH1A1 (0.35) TSHR

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-20020039701-A1 Resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2002-04-04 US disclosed