SCHEMBL1573980

SCHEMBL1573980

O=C(Oc1n[nH]c2cc(F)ccc12)N1Cc2ccccc2CN1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ROCK1 Q13464 3/20 0.41
MAP2K4 P45985 6/20 0.39
AHR P35869 1/20 0.38
RBP4 P02753 1/20 0.38
MAPK1 P28482 1/20 0.37
MAPK6 Q16659 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
TAS1R2 Q8TE23 1/20 0.35
ROCK2 O75116 3/20 0.35
ABL1 P00519 1/20 0.35
BCR P11274 1/20 0.35
NAMPT P43490 1/20 0.35
HTR2A P28223 2/20 0.34
ITK Q08881 1/20 0.34
L3MBTL1 Q9Y468 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
SCHEMBL1574020 0.83 L3MBTL1 (0.47) ROCK1AHRL3MBTL1
SCHEMBL1573919 0.77 HRH4 (0.47) MAP2K4MAPK1MAPK6ABL1BCR
SCHEMBL1573862 0.76 ALDH1A1 (0.44) MAP2K4RBP4MAPK1MAPK6ABL1
SCHEMBL1574085 0.75 ALOX15 (0.54) MAP2K4RBP4MAPK1
SCHEMBL1573781 0.74 MAP2K4 (0.41) ROCK1MAP2K4AHRRBP4MAPK1
SCHEMBL1573854 0.74 RBP4 (0.45) MAP2K4RBP4MAPK1MAPK6ABL1
SCHEMBL1574198 0.74 TP53 (0.47) MAP2K4MAPK1MAPK6ABL1BCR
SCHEMBL1573920 0.74 MAP2K4 (0.41) ROCK1MAP2K4AHRRBP4MAPK1
SCHEMBL1573971 0.73 MAP2K4 (0.42) MAP2K4RBP4MAPK1MAPK6ABL1
SCHEMBL1574048 0.73 GRM4 (0.41) MAP2K4RBP4MAPK1MAPK6ABL1

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
EP-1713779-B1 INDAZOLE DERIVATIVES AS INHIBITORS OF HORMONE-SENSITIVE LIPASES SANOFI AVENTIS DEUTSCHLAND (DE) 2011-04-13 EP disclosed