SCHEMBL25527237

SCHEMBL25527237

O=C(CCS)OC1CCCC(C(=O)O)C1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.41
NAAA Q02083 2/20 0.38
ACE P12821 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
BTK Q06187 1/20 0.35
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.32

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
SCHEMBL6863925 0.85 LMNA (0.40) ANPEPNAAASMN1; SMN2BTKALDH1A1
SCHEMBL13821877 0.80 BTK (0.41) ANPEPNAAASMN1; SMN2BTKALDH1A1
SCHEMBL25946775 0.80 ANPEP (0.36) ANPEPNAAASMN1; SMN2BTKTSHR
SCHEMBL22279606 0.80 ANPEP (0.36) ANPEPNAAASMN1; SMN2BTKTSHR
SCHEMBL25527241 0.80 NAAA (0.39) ANPEPNAAAACESMN1; SMN2TSHR
SCHEMBL5829801 0.77 NAAA (0.58) NAAASMN1; SMN2ALDH1A1TSHRCYP2C19
SCHEMBL11590642 0.77 POLB (0.47) ALDH1A1CYP2C19
SCHEMBL20858078 0.76 KMT2A (0.42) SMN1; SMN2ALDH1A1
SCHEMBL593981 0.74
SCHEMBL331525 0.74 NAAA (0.46) NAAASMN1; SMN2ALDH1A1TSHRCYP2C19

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230152696-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-18 US disclosed
US-20230152696-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-18 US disclosed