SCHEMBL11620512

SCHEMBL11620512

Cc1cn(C(C)(C)C(N)=O)nc1-c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.40
▸ KMT2A Q03164 4/20 0.40
▸ ALDH1A1 P00352 4/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ KDM4E B2RXH2 3/20 0.40
▸ GAA P10253 2/20 0.40
▸ MAPT P10636 2/20 0.39
▸ LMNA P02545 3/20 0.38
▸ ADORA3 P0DMS8 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ ADORA2A P29274 1/20 0.38
▸ ADORA2B P29275 1/20 0.38
▸ ADORA1 P30542 1/20 0.38
▸ KAT2B Q92831 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ CSF1R P07333 1/20 0.37
▸ FGFR1 P11362 1/20 0.37
▸ FLT1 P17948 1/20 0.37
▸ KDR P35968 1/20 0.37
▸ CSNK1A1 P48729 1/20 0.37

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
SCHEMBL11623223 0.88 KMT2A (0.41) POLBKMT2AALDH1A1MEN1KDM4E
SCHEMBL11620869 0.82 SMN1; SMN2 (0.41) POLBKMT2AALDH1A1MEN1KDM4E
SCHEMBL11622323 0.82 LMNA (0.39) POLBKMT2AALDH1A1MEN1KDM4E
SCHEMBL11621422 0.81 CSNK1D (0.41) POLBKMT2AALDH1A1MEN1KDM4E
SCHEMBL19121456 0.80 SMN1; SMN2 (0.40) POLBKMT2AALDH1A1MEN1KDM4E
SCHEMBL11622312 0.80 AURKA (0.44) POLBALDH1A1KDM4EGAAMAPT
SCHEMBL11623222 0.79 ALDH1A1 (0.39) POLBKMT2AALDH1A1MEN1KDM4E
SCHEMBL11622045 0.79 LMNA (0.44) POLBKMT2AALDH1A1MEN1MAPT
SCHEMBL11621699 0.79 KMT2A (0.39) KMT2AMEN1KDM4EGAALMNA
SCHEMBL11619369 0.79 ALDH1A1 (0.41) POLBKMT2AALDH1A1MEN1GAA

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-4072498-A HERBICIDES THE UPJOHN COMPANY (US) 1978-02-07 — — US disclosed
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