SCHEMBL11640160

SCHEMBL11640160

N#CC(CCC(=O)O)(c1cccc(C(F)(F)F)c1)N1CCOCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.42
▸ KMT2A Q03164 2/20 0.41
▸ LMNA P02545 3/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ CTSK P43235 1/20 0.39
▸ FFAR1 O14842 1/20 0.39
▸ TRPV4 Q9HBA0 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ THRB P10828 1/20 0.38
▸ EPHX2 P34913 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ CASP1 P29466 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ CASP7 P55210 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ S1PR4 O95977 1/20 0.38
▸ S1PR5 Q9H228 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ FKBP1A P62942 1/20 0.38

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
SCHEMBL11460905 0.86 GAA (0.46) ALDH1A1KMT2ALMNAKDM4ESMN1; SMN2
SCHEMBL11628340 0.75 MAPT (0.39) ALDH1A1LMNAKDM4ESMN1; SMN2HPGD
SCHEMBL7131453 0.69 FFAR1 (0.43) ALDH1A1KDM4ESMN1; SMN2CTSKFFAR1
SCHEMBL5282593 0.69 GAA (0.46) ALDH1A1LMNAKDM4ESMN1; SMN2HTT
SCHEMBL11622951 0.67 ALDH1A1 (0.41) ALDH1A1KMT2ALMNAKDM4ESMN1; SMN2
SCHEMBL12125729 0.65 KMT2A (0.64) ALDH1A1KMT2ALMNASMN1; SMN2TRPV4
SCHEMBL7581128 0.64 POLB (0.74) ALDH1A1KMT2ALMNAKDM4ESMN1; SMN2
SCHEMBL436892 0.64 EPHX2 (0.52) FFAR1EPHX2
SCHEMBL11157410 0.64 GAA (0.43) ALDH1A1LMNAKDM4ESMN1; SMN2GAA
SCHEMBL3260665 0.63 HSP90AA1 (0.67) KMT2ALMNATRPV4MEN1EPHX2

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
US-4117130-A 6-PHENYL-1,2,4-TRIAZOLO(4,3-B)PYRIDAZINES AMERICAN CYANAMID COMPANY (US) 1978-09-26 — — US disclosed
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