SCHEMBL20195620

SCHEMBL20195620

Cc1nccnc1OCc1c(F)cccc1N(C)N

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.32
ALDH1A1 P00352 3/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KDM4E B2RXH2 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
RAB9A P51151 1/20 0.31
KCNH2 Q12809 1/20 0.31
GUCY1B2 O75343 1/20 0.30
GUCY1A2 P33402 1/20 0.30
GUCY1A1 Q02108 1/20 0.30
GUCY1B1 Q02153 1/20 0.30
MEN1 O00255 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL20195570 0.83 TAAR1 (0.35)
SCHEMBL20195505 0.82 ADRA2A (0.33) KMT2AALDH1A1L3MBTL1KDM4ESMN1; SMN2
SCHEMBL20195450 0.81 HDAC1 (0.38)
SCHEMBL20195414 0.74 TDP1 (0.41) KMT2AALDH1A1ATML3MBTL1KDM4E
SCHEMBL18831566 0.72 MRGPRX4 (0.37) SMN1; SMN2
SCHEMBL20195407 0.71 HTR7 (0.32) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL20195499 0.70 GABRA5 (0.47) ALDH1A1KDM4ESMN1; SMN2RAB9AGAA
SCHEMBL20195500 0.69 HTT (0.33) KMT2AL3MBTL1MEN1GAA
SCHEMBL18831542 0.69 KDM4E (0.40) ALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL20195504 0.68 GRM5 (0.36) KMT2AALDH1A1L3MBTL1KDM4ESMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3029035-B1 TETRAZOLINONE COMPOUND, AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2018-05-30 EP disclosed