SCHEMBL28459342

SCHEMBL28459342

NC(=O)Oc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 1/20 0.66
▸ KMT2A Q03164 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ PRSS1 P07477 2/20 0.42
▸ ACR P10323 2/20 0.42
▸ MAOB P27338 3/20 0.41
▸ ALDH1A1 P00352 1/20 0.37
▸ CES2 O00748 1/20 0.36
▸ CES1 P23141 1/20 0.36
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ KCNN4 O15554 1/20 0.34
▸ ELANE P08246 1/20 0.33
▸ PTPRC P08575 1/20 0.33
▸ PTPN2 P17706 1/20 0.33
▸ PTPN1 P18031 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
SCHEMBL4316832 0.84 KIF11 (0.89) KIF11KMT2AMEN1PRSS1ACR
SCHEMBL28365026 0.83 KIF11 (0.64) KIF11KMT2AMEN1PRSS1ACR
SCHEMBL28909073 0.82 KIF11 (0.86) KIF11KMT2AMEN1PRSS1ACR
SCHEMBL29177337 0.81 KIF11 (0.66) KIF11KMT2AMEN1PRSS1ACR
SCHEMBL4598278 0.80 KIF11 (0.60) KIF11KMT2AMEN1
SCHEMBL6284986 0.78 KMT2A (0.64) KIF11KMT2AMEN1PRSS1ALDH1A1
SCHEMBL9575156 0.78 KIF11 (0.41) KIF11KMT2APRSS1ACRMAOB
SCHEMBL28367788 0.78 KIF11 (0.57) KIF11KMT2AMEN1PRSS1ACR
SCHEMBL21628511 0.77 PARP10 (0.66) KMT2APRSS1MAOBALDH1A1CA1
SCHEMBL28367562 0.76 KIF11 (0.55) KIF11KMT2AMEN1PRSS1ACR

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
CN-111533701-B Synthetic method of pyridine quinazoline intermediate 湖南速博生物技术有限公司 2020-10-16 — — CN disclosed
CN-111533701-A Synthetic method of pyridine quinazoline intermediate 湖南速博生物技术有限公司 2020-08-14 — — CN disclosed
Send feedback