SCHEMBL8490348

SCHEMBL8490348

FCc1ccccc1CCNc1ncnc2sccc12

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 5/20 0.65
▸ SMN1; SMN2 Q16637 4/20 0.65
▸ MEN1 O00255 4/20 0.63
▸ KMT2A Q03164 4/20 0.63
▸ TNF P01375 3/20 0.56
▸ NOD1 Q9Y239 3/20 0.56
▸ LMNA P02545 5/20 0.54
▸ TSHR P16473 1/20 0.53
▸ RAB9A P51151 4/20 0.53
▸ NPC1 O15118 3/20 0.53
▸ GALR3 O60755 1/20 0.53
▸ NR2F2 P24468 1/20 0.53
▸ MAPK1 P28482 2/20 0.47
▸ TP53 P04637 1/20 0.46

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
SCHEMBL8482940 0.88 MEN1 (0.77) HTTSMN1; SMN2MEN1KMT2ATNF
SCHEMBL8504006 0.86 HTT (0.64) HTTSMN1; SMN2MEN1KMT2ATNF
SCHEMBL8505625 0.86 HTT (0.64) HTTSMN1; SMN2MEN1KMT2ATNF
SCHEMBL8483111 0.85 HTT (0.60) HTTSMN1; SMN2MEN1KMT2ATNF
SCHEMBL8490055 0.85 KMT2A (0.61) HTTSMN1; SMN2MEN1KMT2ATNF
SCHEMBL8489792 0.83 KMT2A (0.78) HTTSMN1; SMN2MEN1KMT2ATNF
SCHEMBL1904097 0.82 HTT (0.70) HTTSMN1; SMN2MEN1KMT2ATNF
SCHEMBL8482830 0.82 MEN1 (0.57) HTTSMN1; SMN2MEN1KMT2ATNF
SCHEMBL9607974 0.80 MEN1 (0.55) HTTSMN1; SMN2MEN1KMT2ATNF
SCHEMBL8504041 0.80 HTT (0.74) HTTSMN1; SMN2MEN1KMT2ATNF

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-2455371-A1 4-(3-BUTYNYL)AMINOPYRIMIDINE DERIVATIVES AS PEST CONTROL AGENTS FOR AGRICULTURAL AND HORTICULTURAL USE SDS Biotech K. K. (JP) 2012-05-23 — — EP disclosed
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