SCHEMBL8978492

SCHEMBL8978492

C/C(=C\CCC(C)CCCC(C)O)CCCC(C)C

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.65
KDM1A O60341 1/20 0.50
PTGS1 P23219 1/20 0.44
PDE4A P27815 1/20 0.44
SNCA P37840 1/20 0.44
PDE3A Q14432 1/20 0.44
LMNA P02545 1/20 0.42
PTPN2 P17706 1/20 0.39
CDC25B P30305 1/20 0.39
ALOX15 P16050 2/20 0.38
ALDH1A1 P00352 1/20 0.38
BLM P54132 1/20 0.37
MEN1 O00255 1/20 0.37
CYP3A4 P08684 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL8978494 1.00 PTPN1 (0.65) PTPN1KDM1APTGS1PDE4ASNCA
SCHEMBL8978488 0.95 PTPN1 (0.67) PTPN1KDM1APTGS1PDE4ASNCA
SCHEMBL8978484 0.95 PTPN1 (0.67) PTPN1KDM1APTGS1PDE4ASNCA
SCHEMBL8907996 0.88 KDM1A (0.57) PTPN1KDM1APTGS1PDE4ASNCA
SCHEMBL11403657 0.87 PTPN1 (0.65) PTPN1KDM1APTGS1PDE4ASNCA
SCHEMBL889907 0.87 PTPN1 (0.51) PTPN1KDM1APTGS1PDE4ASNCA
SCHEMBL11403680 0.87 PTPN1 (0.65) PTPN1KDM1APTGS1PDE4ASNCA
SCHEMBL8978516 0.85 ALOX15 (0.52) PTPN1KDM1AALOX15ALDH1A1KMT2A
SCHEMBL27414780 0.85 PTPN1 (0.83) PTPN1KDM1APTGS1PDE4ASNCA
SCHEMBL8978519 0.85 ALOX15 (0.52) PTPN1KDM1AALOX15ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0577356-B1 Topical composition for preventing or treating acne vulgaris TAKASAGO PERFUMERY CO LTD (JP) 1996-05-01 EP disclosed
US-5344850-A Branched long chain alcohol, bactericide effective against Propionibacterium TAKASAGO INTERNATIONAL CORPORATION (JP) 1994-09-06 US disclosed
EP-0577356-A1 Topical composition for preventing or treating acne vulgaris Takasago International Corporation (JP) 1994-01-05 EP disclosed