SCHEMBL20737984

SCHEMBL20737984

C/C=C\C(=C/C)NC(=O)C(=O)Nc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NAPRT Q6XQN6 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ RAB9A P51151 8/20 0.44
▸ NPC1 O15118 7/20 0.44
▸ PKM P14618 3/20 0.44
▸ SMN1; SMN2 Q16637 6/20 0.43
▸ KMT2A Q03164 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ HDAC3 O15379 1/20 0.42
▸ HDAC4 P56524 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ HDAC7 Q8WUI4 1/20 0.42
▸ HDAC2 Q92769 1/20 0.42
▸ HDAC10 Q969S8 1/20 0.42
▸ HDAC11 Q96DB2 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42
▸ HDAC9 Q9UKV0 1/20 0.42
▸ HDAC5 Q9UQL6 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42

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
SCHEMBL18827102 0.89 MAOB (0.42) NAPRTHSD17B10RAB9ANPC1PKM
SCHEMBL25452823 0.85 SMN1; SMN2 (0.53) NAPRTHSD17B10RAB9ANPC1SMN1; SMN2
SCHEMBL20404365 0.84 TGM2 (0.44) NAPRTHSD17B10RAB9ANPC1PKM
SCHEMBL20433894 0.83 TGM2 (0.53) NAPRTHSD17B10RAB9ANPC1PKM
SCHEMBL18473251 0.80 GAA (0.45) NAPRTHSD17B10RAB9ANPC1SMN1; SMN2
SCHEMBL20433901 0.77 NAPRT (0.53) NAPRTHSD17B10RAB9ANPC1PKM
SCHEMBL14194401 0.76 NAPRT (0.52) NAPRTHSD17B10RAB9ANPC1PKM
Benzene SCHEMBL28977956 0.75 SMN1; SMN2 (0.70) NAPRTHSD17B10RAB9ANPC1PKM
SCHEMBL57554 0.75 SMN1; SMN2 (0.70) NAPRTHSD17B10RAB9ANPC1PKM
SCHEMBL18674136 0.75 NAPRT (0.50) NAPRTHSD17B10RAB9ANPC1PKM

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
US-10921489-B2 Polymerizable composition for optical material, optical material obtained from the composition, and plastic lens MITSUI CHEMICALS, INC. (JP) 2021-02-16 — — US disclosed
US-20190048122-A1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, OPTICAL MATERIAL OBTAINED FROM THE COMPOSITION, AND PLASTIC LENS MITSUI CHEMICALS, INC. (JP) 2019-02-14 — — US disclosed
Send feedback