SCHEMBL27460549

SCHEMBL27460549

CCCC(=N)c1cc(C(=O)Nc2ccc(Cl)cn2)ccc1[N+](=O)[O-]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 7/20 0.51
▸ SMN1; SMN2 Q16637 6/20 0.51
▸ NPC1 O15118 6/20 0.51
▸ TP53 P04637 4/20 0.51
▸ MAPT P10636 2/20 0.51
▸ CYP1A2 P05177 2/20 0.51
▸ CYP2D6 P10635 2/20 0.51
▸ CYP2C19 P33261 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ RECQL P46063 1/20 0.51
▸ NFKB1 P19838 2/20 0.50
▸ NFKB2 Q00653 2/20 0.50
▸ RELA Q04206 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ LMNA P02545 2/20 0.50
▸ POLB P06746 1/20 0.50
▸ CASP3 P42574 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ SENP8 Q96LD8 1/20 0.50

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
SCHEMBL4858718 0.79 KMT2A (0.67) RAB9ASMN1; SMN2NPC1TP53MAPT
SCHEMBL1455153 0.78 LMNA (0.64) RAB9ASMN1; SMN2NPC1TP53MAPT
SCHEMBL2433512 0.77 POLB (0.67) RAB9ASMN1; SMN2NPC1MAPTKMT2A
SCHEMBL890692 0.76 POLB (0.71) RAB9ASMN1; SMN2NPC1TP53MAPT
SCHEMBL27508802 0.75 F10 (0.50) RAB9ASMN1; SMN2NPC1KMT2AMEN1
SCHEMBL15855141 0.74 POLB (0.60) RAB9ASMN1; SMN2NPC1MAPTKMT2A
SCHEMBL3152166 0.73 POLB (0.58) RAB9ASMN1; SMN2NPC1MAPTKMT2A
SCHEMBL6107813 0.73 KMT2A (0.71) RAB9ASMN1; SMN2NPC1MAPTKMT2A
SCHEMBL297441 0.73 RAB9A (0.59) RAB9ASMN1; SMN2NPC1TP53MAPT
SCHEMBL3156502 0.73 POLB (0.82) RAB9ASMN1; SMN2NPC1MAPTCYP1A2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1143855-C I (ortho)-anthranilamide derivatives as anti-coagulants ���ֹɷݹ�˾ 2004-03-31 — — CN disclosed
CN-1282329-A I (ortho)-anthranilamide derivatives as anti-coagulants SCHERING AG (DE) 2001-01-31 — — CN disclosed
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