SCHEMBL5593155

SCHEMBL5593155

Cc1cc(F)c(-c2c(C)nc3ncnn3c2NC(C)C(F)(F)F)cc1F

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.39
TSHR P16473 2/20 0.39
ALOX15 P16050 1/20 0.39
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
EGLN2 Q96KS0 1/20 0.34
ABL1 P00519 1/20 0.34

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
SCHEMBL5593490 0.92 MAPK1 (0.39) MAPK1TSHRALOX15HTTSMN1; SMN2
SCHEMBL5593412 0.90 TSHR (0.35) MAPK1TSHRALOX15EGLN2ABL1
SCHEMBL5593188 0.88 CYP1A2 (0.42) MAPK1TSHRHTTSMN1; SMN2ABL1
SCHEMBL5593334 0.88 MAPK1 (0.34) MAPK1TSHRALOX15HTTSMN1; SMN2
SCHEMBL5593444 0.87 EGLN2 (0.40) MAPK1TSHRALOX15HTTEGLN2
SCHEMBL5593145 0.87 MAPK1 (0.40) MAPK1TSHRALOX15HTTSMN1; SMN2
SCHEMBL5593434 0.85 MAPK1 (0.40) MAPK1TSHRALOX15HTTSMN1; SMN2
SCHEMBL974956 0.84 MAPK1 (0.41) MAPK1TSHRALOX15HTTSMN1; SMN2
SCHEMBL5593373 0.82 TSHR (0.40) MAPK1TSHRALOX15HTTSMN1; SMN2
SCHEMBL5593451 0.82 MBOAT4 (0.42) MAPK1TSHRALOX15HTTSMN1; SMN2

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
WO-2007099092-A1 SUBSTITUTED 6-PHENYL-7-AMINO[1,2,4]-TRIAZOLO[1,5-a]PYRIMIDINES AND THEIR USE FOR CONTROLLING PATHOGENIC FUNGI BASF SE (DE) 2007-09-07 WO claimed
WO-2007099092-A1 SUBSTITUTED 6-PHENYL-7-AMINO[1,2,4]-TRIAZOLO[1,5-a]PYRIMIDINES AND THEIR USE FOR CONTROLLING PATHOGENIC FUNGI BASF SE (DE) 2007-09-07 WO disclosed