SCHEMBL21084979

SCHEMBL21084979

C=C(CCCC(C)C)NC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
CYP3A4 P08684 1/20 0.35
ALOX15 P16050 1/20 0.35
KMT2A Q03164 1/20 0.35
PTPN1 P18031 1/20 0.32
LMNA P02545 1/20 0.31

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
SCHEMBL24241989 0.76 MEN1 (0.36) MEN1KMT2A
SCHEMBL23449249 0.76 LMNA (0.35) MEN1CYP3A4ALOX15KMT2APTPN1
SCHEMBL18935501 0.76 MEN1 (0.31) MEN1KMT2A
SCHEMBL13669849 0.75 ALDH1A1 (0.42) LMNA
SCHEMBL20028949 0.74 PTPN1 (0.33) MEN1KMT2APTPN1LMNA
SCHEMBL21472280 0.73 MEN1 (0.31) MEN1CYP3A4ALOX15KMT2A
SCHEMBL23346107 0.72
SCHEMBL21904892 0.72 PTPN1 (0.32) PTPN1LMNA
SCHEMBL19193277 0.72 PTPN1 (0.32) PTPN1LMNA
SCHEMBL20048861 0.71 KDM4C (0.33) PTPN1LMNA

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-20190169679-A1 ONE-STEP REVERSE TRANSCRIPTION TEMPLATE-SWITCHING PCR RIKEN (JP) 2019-06-06 US disclosed