SCHEMBL6054991

SCHEMBL6054991

CC#Cc1ccc(NC(=O)c2cccnc2)cc1C(F)(F)F

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.58
▸ KMT2A Q03164 3/20 0.58
▸ TSHR P16473 2/20 0.58
▸ RAB9A P51151 5/20 0.55
▸ TDP1 Q9NUW8 1/20 0.54
▸ CSF1R P07333 2/20 0.53
▸ BRAF P15056 1/20 0.53
▸ NPC1 O15118 4/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ ALDH1A1 P00352 2/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ POLB P06746 1/20 0.52
▸ KCNK3 O14649 1/20 0.51
▸ TRPA1 O75762 1/20 0.51
▸ LMNA P02545 1/20 0.50
▸ HIF1A Q16665 1/20 0.50
▸ RXFP1 Q9HBX9 1/20 0.49
▸ EPHX2 P34913 1/20 0.49
▸ HTT P42858 1/20 0.49

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
SCHEMBL6204560 0.86 MAPT (0.62) MEN1KMT2ARAB9ANPC1KCNK3
SCHEMBL5694537 0.83 MEN1 (0.68) MEN1KMT2ATSHRRAB9ATDP1
SCHEMBL7544775 0.81 RAB9A (0.62) MEN1KMT2ATSHRRAB9ATDP1
SCHEMBL5694529 0.80 MEN1 (0.72) MEN1KMT2ATSHRRAB9ACSF1R
SCHEMBL6054898 0.78 TRPA1 (0.59) MEN1KMT2ATSHRRAB9ATDP1
SCHEMBL6055054 0.77 ROCK2 (0.64) MEN1KMT2ARAB9ATDP1NPC1
SCHEMBL3113266 0.74 KDR (0.45) —
SCHEMBL5665029 0.74 EPHX2 (0.76) MEN1KMT2ATSHRRAB9ACSF1R
SCHEMBL3113260 0.74 KDR (0.73) CSF1RBRAF
SCHEMBL5178391 0.73 MEN1 (1.00) MEN1KMT2ATSHRCSF1RBRAF

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-1259487-A1 2-AMINO-NICOTINAMIDE DERIVATIVES AND THEIR USE AS VEGF-RECEPTOR TYROSINE KINASE INHIBITORS Novartis AG (CH) 2002-11-27 — — EP claimed
WO-2001055114-A1 2-AMINO-NICOTINAMIDE DERIVATIVES AND THEIR USE AS VEGF-RECEPTOR TYROSINE KINASE INHIBITORS NOVARTIS AG (CH) 2001-08-02 — — WO claimed
EP-1682181-A2 COMBINATION OF A VEGF RECEPTOR INHIBITOR WITH A CHEMOTHERAPEUTIC AGENT Novartis AG (CH) 2006-07-26 — — EP disclosed
WO-2005027972-A2 COMBINATION OF A VEGF RECEPTOR INHIBITOR WITH A CHEMOTHERAPEUTIC AGENT NOVARTIS AG (CH) 2005-03-31 — — WO disclosed
EP-1259487-A1 2-AMINO-NICOTINAMIDE DERIVATIVES AND THEIR USE AS VEGF-RECEPTOR TYROSINE KINASE INHIBITORS Novartis AG (CH) 2002-11-27 — — EP disclosed
WO-2001055114-A1 2-AMINO-NICOTINAMIDE DERIVATIVES AND THEIR USE AS VEGF-RECEPTOR TYROSINE KINASE INHIBITORS NOVARTIS AG (CH) 2001-08-02 — — WO disclosed
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