SCHEMBL11160397

SCHEMBL11160397

O=c1nc(-c2ccccc2)c2cc([N+](=O)[O-])ccc2n1CCCl

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.57
▸ KMT2A Q03164 4/20 0.52
▸ OPRK1 P41145 1/20 0.52
▸ MAPT P10636 5/20 0.46
▸ POLB P06746 2/20 0.46
▸ ATM Q13315 1/20 0.46
▸ MEN1 O00255 3/20 0.45
▸ LMNA P02545 2/20 0.45
▸ HPGD P15428 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ F2RL3 Q96RI0 3/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ F2R P25116 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ CYP19A1 P11511 1/20 0.44
▸ CFTR P13569 4/20 0.43
▸ ACHE P22303 1/20 0.43
▸ BACE1 P56817 1/20 0.43
▸ DYRK1A Q13627 1/20 0.43
▸ TP53 P04637 1/20 0.43

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
SCHEMBL11167732 0.89 MAPT (0.61) L3MBTL1KMT2AOPRK1MAPTPOLB
SCHEMBL11861596 0.88 L3MBTL1 (0.59) L3MBTL1KMT2AOPRK1MAPTPOLB
SCHEMBL3471111 0.87 L3MBTL1 (0.55) L3MBTL1KMT2AOPRK1CFTRALOX5
SCHEMBL11604828 0.86 KMT2A (0.60) L3MBTL1KMT2AOPRK1MAPTPOLB
SCHEMBL11638539 0.86 L3MBTL1 (0.57) L3MBTL1KMT2AOPRK1MAPTPOLB
SCHEMBL11550177 0.84 L3MBTL1 (0.52) L3MBTL1KMT2AOPRK1MAPTMEN1
SCHEMBL11160245 0.84 L3MBTL1 (0.55) L3MBTL1KMT2AOPRK1MAPTPOLB
SCHEMBL11634947 0.84 MAPT (0.56) L3MBTL1KMT2AOPRK1MAPTPOLB
SCHEMBL11163429 0.83 L3MBTL1 (0.53) L3MBTL1KMT2AOPRK1MAPTPOLB
SCHEMBL11469865 0.83 L3MBTL1 (0.53) L3MBTL1KMT2AOPRK1MAPTPOLB

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-4387223-A Process for preparing 2(1H)-quinazolinone derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-06-07 — — US disclosed
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