SCHEMBL21840975

SCHEMBL21840975

NCCCNC(=O)C1CCCCC1C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 5/20 0.55
HSD17B10 Q99714 2/20 0.51
ALDH1A1 P00352 2/20 0.51
CASP1 P29466 1/20 0.51
LMNA P02545 1/20 0.47
GLA P06280 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PEPD P12955 1/20 0.44
HTR1A P08908 1/20 0.44

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
SCHEMBL8355991 0.95 TAAR1 (0.54) TAAR1HSD17B10ALDH1A1CASP1LMNA
SCHEMBL18469262 0.93 TAAR1 (0.52) TAAR1HSD17B10ALDH1A1CASP1LMNA
SCHEMBL14159195 0.89 TAAR1 (0.58) TAAR1HSD17B10ALDH1A1CASP1LMNA
SCHEMBL20123261 0.86 TAAR1 (0.49) TAAR1HSD17B10ALDH1A1CASP1LMNA
SCHEMBL9518382 0.83 TAAR1 (0.55) TAAR1HSD17B10ALDH1A1CASP1GLA
SCHEMBL10173738 0.83 POLB (0.58) TAAR1HSD17B10ALDH1A1CASP1
SCHEMBL12650951 0.81 POLB (0.65) TAAR1
SCHEMBL13818150 0.81 TAAR1 (0.47) TAAR1HSD17B10ALDH1A1CASP1GLA
SCHEMBL20123259 0.81 POLB (0.42) TAAR1HSD17B10ALDH1A1CASP1
SCHEMBL16141270 0.80 TAAR1 (0.52) TAAR1HSD17B10ALDH1A1CASP1GLA

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
WO-2021220919-A1 METHOD FOR PRODUCING SURFACE-MODIFIED METAL OXIDE MICROPARTICLES, METHOD FOR PRODUCING SURFACE-MODIFIED METAL OXIDE MICROPARTICLE DISPERSION, AND METHOD FOR PRODUCING SOLID PRODUCT 東京応化工業株式会社 2021-11-04 WO disclosed
EP-3318606-B1 SILICON-CONTAINING RESIN COMPOSITION TOKYO OHKA KOGYO CO LTD (JP) 2020-03-18 EP disclosed