SCHEMBL1433055

SCHEMBL1433055

CN1CCCC1C(=O)N[C@@H](Cc1cccc(F)c1)C(=O)NCc1ccc(N)nc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ CCNT1 O60563 2/20 0.42
▸ TACR1 P25103 1/20 0.41
▸ AADAT Q8N5Z0 1/20 0.40
▸ MASP2 O00187 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ TLR2 O60603 1/20 0.39
▸ XIAP P98170 2/20 0.38
▸ KLKB1 P03952 1/20 0.38
▸ CTSS P25774 1/20 0.38
▸ CTSK P43235 1/20 0.38
▸ PPIB P23284 1/20 0.38
▸ POLB P06746 1/20 0.38

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
SCHEMBL1432319 1.00 KMT2A (0.43) KMT2AMEN1CCNT1TACR1AADAT
SCHEMBL1432452 0.93 TLR2 (0.42) KMT2AMEN1CCNT1TACR1AADAT
SCHEMBL1432690 0.93 TLR2 (0.42) KMT2AMEN1CCNT1TACR1AADAT
SCHEMBL1432803 0.91 CTSB (0.41) KMT2AMEN1MASP2ALDH1A1KLKB1
SCHEMBL1431638 0.91 DPP4 (0.40) KMT2AMEN1MASP2ALDH1A1LMNA
SCHEMBL1432180 0.91 DPP4 (0.40) KMT2AMEN1MASP2ALDH1A1LMNA
SCHEMBL1432532 0.91 MEN1 (0.48) KMT2AMEN1TACR1AADATMASP2
SCHEMBL1431814 0.91 MEN1 (0.48) KMT2AMEN1TACR1AADATMASP2
SCHEMBL1432409 0.90 CTSL (0.48) CTSSCTSK
Hydrochloric Acid SCHEMBL1432515 0.90 DPP4 (0.40) KMT2AMEN1MASP2ALDH1A1LMNA

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-2300428-A1 AMINOPYRIDINE DERIVATIVES Vantia Limited (GB) 2011-03-30 — — EP disclosed
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