SCHEMBL12003317

SCHEMBL12003317

CCOC(=O)NCC=CF

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GLA P06280 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ GAA P10253 2/20 0.38
▸ MGAM O43451 1/20 0.38
▸ SI P14410 1/20 0.38
▸ MGAM2 Q2M2H8 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ TSHR P16473 1/20 0.36
▸ CYP1A2 P05177 2/20 0.35
▸ HDAC3 O15379 1/20 0.35
▸ HDAC4 P56524 1/20 0.35
▸ HDAC1 Q13547 1/20 0.35
▸ HDAC7 Q8WUI4 1/20 0.35
▸ HDAC2 Q92769 1/20 0.35
▸ HDAC10 Q969S8 1/20 0.35
▸ HDAC11 Q96DB2 1/20 0.35
▸ HDAC8 Q9BY41 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35

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
SCHEMBL2338040 0.82 GAA (0.39) GLAKMT2AGAAMGAMSI
SCHEMBL28815661 0.82 GAA (0.39) GLAKMT2AGAAMGAMSI
SCHEMBL3260744 0.78 HCAR2 (0.48) KMT2AGAAMGAMSIMGAM2
SCHEMBL12393899 0.77 NR1I2 (0.45) GLAKMT2AGAAMGAMSI
SCHEMBL9772247 0.77 GAA (0.36) GLAKMT2AGAAMGAMSI
SCHEMBL11601388 0.77 GLA (0.41) GLAKMT2AGAAMGAMSI
SCHEMBL1147121 0.77 — —
SCHEMBL2335067 0.76 CYP2C9 (0.41) GLAKMT2AGAAMGAMSI
SCHEMBL87647 0.75 — —
SCHEMBL1149476 0.74 ALOX15 (0.42) GLAKMT2AGAAMGAMSI

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
EP-2132232-B1 POLYMERIC DISPERSIONS AND APPLICATIONS THEREOF PEACH STATE LABS INC (US) 2012-08-29 — — EP claimed
CN-114606778-A Environment-friendly degradable non-woven fabric and preparation method thereof 南通雄风服装有限公司 2022-06-10 — — CN disclosed
Send feedback