SCHEMBL10705274

SCHEMBL10705274

COC(=O)N(c1ccccc1Cc1ccccc1N(C(=O)OC)C(C)C)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 2/20 0.38
TP53 P04637 1/20 0.38
HTT P42858 2/20 0.38
KDM4E B2RXH2 2/20 0.38
APAF1 O14727 1/20 0.38
NPC1 O15118 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
P2RX4 Q99571 2/20 0.37
HPGD P15428 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
TDP1 Q9NUW8 1/20 0.35
TSHR P16473 1/20 0.35
MEN1 O00255 1/20 0.35
KEAP1 Q14145 2/20 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
SCHEMBL4323999 0.77 KMT2A (0.60) KMT2AALDH1A1LMNAKDM4EHPGD
SCHEMBL17735706 0.74 ALDH1A1 (0.56) KMT2AALDH1A1SMN1; SMN2LMNATP53
SCHEMBL2545750 0.73 HSPA5 (0.36) KMT2AALDH1A1SMN1; SMN2LMNATP53
SCHEMBL8614764 0.70 ALDH1A1 (0.44) KMT2AALDH1A1SMN1; SMN2LMNATP53
SCHEMBL10723987 0.70 HDAC1 (0.41) KMT2AALDH1A1SMN1; SMN2LMNATP53
SCHEMBL11253016 0.70 TP53 (0.45) ALDH1A1SMN1; SMN2LMNATP53HTT
SCHEMBL28593004 0.69 KDM4E (0.38) KMT2AALDH1A1LMNAHTTKDM4E
SCHEMBL1461137 0.68 ALDH1A1 (0.36) KMT2AALDH1A1LMNAHTTKDM4E
SCHEMBL27861510 0.68 ALDH1A1 (0.61) KMT2AALDH1A1SMN1; SMN2LMNATP53
SCHEMBL10061323 0.67 PTGER1 (0.37) KMT2AALDH1A1LMNATP53HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0150440-B1 ENAMEL MIXTURES BASED ON HYDANTOIN GROUP CONTAINING POLYMERS AND THEIR APPLICATION BAYER AG (DE) 1988-05-18 EP disclosed
EP-0112528-B1 PROCESS FOR THE PRODUCTION OF HYDANTOIN ESTERS BAYER AG (DE) 1988-04-20 EP disclosed
US-4565843-A Lacquer solutions based on hydantoin group-containing polymers BAYER AKTIENGESELLSCHAFT (DE) 1986-01-21 US disclosed
EP-0150440-A2 Enamel mixtures based on hydantoin group containing polymers and their application BAYER AG (DE) 1985-08-07 EP disclosed
US-4517353-A Process for preparation of hydantoin esters through a masked polyisocyanate-carbodiimide route BAYER AKTIENGESELLSCHAFT (DE) 1985-05-14 US disclosed
EP-0112528-A2 Process for the production of hydantoin esters BAYER AG (DE) 1984-07-04 EP disclosed