SCHEMBL28516172

SCHEMBL28516172

O=[AlH].c1ccc(P(c2ccccc2)c2ccccn2)cc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.80
GAA P10253 1/20 0.80
TDP1 Q9NUW8 2/20 0.44
CYP3A4 P08684 1/20 0.44
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
ATM Q13315 1/20 0.38
LMNA P02545 2/20 0.38
P4HTM Q9NXG6 2/20 0.38
NAPRT Q6XQN6 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP1A2 P05177 1/20 0.36
POLB P06746 1/20 0.36
CCR1 P32246 1/20 0.36
CCR5 P51681 1/20 0.36
CCR8 P51685 1/20 0.36
METAP1 P53582 1/20 0.36
BLM P54132 1/20 0.36

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
SCHEMBL145208 0.94 KDM4E (0.91) KDM4EGAATDP1CYP3A4KMT2A
Hydrochloric Acid SCHEMBL22440642 0.91 KDM4E (0.87) KDM4EGAATDP1CYP3A4KMT2A
SCHEMBL8159223 0.91 KDM4E (0.87) KDM4EGAATDP1CYP3A4KMT2A
Hydrochloric Acid SCHEMBL28961578 0.91 KDM4E (0.87) KDM4EGAATDP1CYP3A4KMT2A
SCHEMBL5471362 0.91 KDM4E (0.87) KDM4EGAATDP1CYP3A4KMT2A
SCHEMBL28507747 0.91 KDM4E (0.87) KDM4EGAATDP1CYP3A4KMT2A
SCHEMBL29096264 0.91 KDM4E (0.87) KDM4EGAATDP1CYP3A4KMT2A
Hydrochloric Acid SCHEMBL28961579 0.89 KDM4E (0.83) KDM4EGAATDP1CYP3A4KMT2A
SCHEMBL1217437 0.89 KDM4E (1.00) KDM4EGAATDP1CYP3A4KMT2A
SCHEMBL31114652 0.87 KDM4E (0.95) KDM4EGAATDP1CYP3A4KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107602370-B Method for synthesizing acrylic acid or acrylic ester 新疆中泰化学股份有限公司 2020-12-08 CN disclosed