SCHEMBL9638388

SCHEMBL9638388

C=C(C(=O)O)C(CC1CCCCC1)(CC1CCCCC1)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.41
GRM3 Q14832 1/20 0.41
METAP1 P53582 1/20 0.36
KDM5A P29375 3/20 0.33
PHF8 Q9UPP1 3/20 0.33
KDM2A Q9Y2K7 3/20 0.33
HPGD P15428 2/20 0.33
KDM4C Q9H3R0 2/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
CA9 Q16790 1/20 0.33
KDM4A O75164 1/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL6516562 0.75 CES2 (0.34) EPHX1
SCHEMBL6515565 0.73 CES2 (0.31)
SCHEMBL11000103 0.71 CYP1A2 (0.47) GRM2GRM3EPHX1
SCHEMBL6521091 0.71 CYP2C19 (0.41) HPGDLMNAEPHX1
SCHEMBL6518199 0.70 CES2 (0.31)
SCHEMBL6517217 0.69 NAAA (0.38) LMNAEPHX1
SCHEMBL4141844 0.68 GRM2 (0.46) GRM2GRM3HPGDMMP1MMP9
SCHEMBL25826250 0.68 GRM2 (0.46) GRM2GRM3HPGDMMP1MMP9
SCHEMBL28752678 0.68 GRM2 (0.46) GRM2GRM3HPGDMMP1MMP9
SCHEMBL7046038 0.68 METAP2 (0.38) GRM2GRM3KMT2AMEN1LMNA

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
US-5149754-A Allyl polymers as antisolilants; halogen-free ALLIED-SIGNAL INC (US) 1992-09-22 US disclosed
US-5006408-A Stain-resistant polymers derived from itaconic acid useful as coatings for fibers ALLIED-SIGNAL INC. (US) 1991-04-09 US disclosed
US-4925906-A DURABILITY; NYLONS ALLIED-SIGNAL INC. (US) 1990-05-15 US disclosed