SCHEMBL11844524

SCHEMBL11844524

CCCCCC1=NCCNC(=O)c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ PTPN1 P18031 1/20 0.40
▸ NISCH Q9Y2I1 3/20 0.40
▸ HTR1D P28221 1/20 0.40
▸ ADRA2C P18825 5/20 0.39
▸ ADRA2B P18089 2/20 0.39
▸ ADRA1A P35348 7/20 0.38
▸ ADRA1D P25100 6/20 0.38
▸ ADRA1B P35368 6/20 0.38
▸ MAOA P21397 1/20 0.38
▸ MAOB P27338 1/20 0.38
▸ ADRA2A P08913 2/20 0.37
▸ PDPK1 O15530 1/20 0.37
▸ PARP1 P09874 1/20 0.37
▸ PARP10 Q53GL7 1/20 0.37
▸ PARP11 Q9NR21 1/20 0.37
▸ LMNA P02545 1/20 0.36

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
SCHEMBL11844515 1.00 MEN1 (0.41) MEN1KMT2AATMPTPN1NISCH
SCHEMBL6157468 0.73 MEN1 (0.45) MEN1KMT2AATMPTPN1MAOA
SCHEMBL6159010 0.73 MEN1 (0.45) MEN1KMT2AATMPTPN1MAOA
SCHEMBL29868676 0.72 KDM4E (0.51) MEN1KMT2AATMPTPN1MAOA
SCHEMBL7759078 0.72 KDM4E (0.51) MEN1KMT2AATMPTPN1MAOA
SCHEMBL7561038 0.71 NISCH (0.54) NISCHADRA2CADRA2BADRA2A
SCHEMBL4764699 0.71 MEN1 (0.51) MEN1KMT2AATMPTPN1MAOA
SCHEMBL27996594 0.71 MEN1 (0.51) MEN1KMT2AATMPTPN1MAOA
SCHEMBL2364518 0.69 GABRA1 (0.54) MEN1KMT2AATMPTPN1ADRA1A
SCHEMBL11870789 0.67 NISCH (0.51) NISCHADRA2CADRA2BADRA1AADRA1D

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-3935218-A Imidazolinyl phenyl carbonyl compounds acid addition salts and related compounds AMERICAN HOME PRODUCTS CORPORATION (US) 1976-01-27 — — US disclosed
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