SCHEMBL11093069

SCHEMBL11093069

CN(c1ccccc1)c1ncnc2cc([N+](=O)[O-])ccc12

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.59
CSF1R P07333 6/20 0.54
PDGFRB P09619 1/20 0.53
PDGFRA P16234 1/20 0.53
ABCG2 Q9UNQ0 2/20 0.53
MAPT P10636 2/20 0.47
ALDH1A1 P00352 2/20 0.47
LMNA P02545 2/20 0.47
PKM P14618 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46

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
Hydrochloric Acid SCHEMBL11086154 0.99 EGFR (0.58) EGFRCSF1RPDGFRBPDGFRAABCG2
SCHEMBL23577599 0.80 MAPT (0.57) EGFRPDGFRBABCG2MAPTALDH1A1
SCHEMBL30961066 0.80 MAPT (0.57) EGFRPDGFRBABCG2MAPTALDH1A1
SCHEMBL23601302 0.77 ABCG2 (0.54) EGFRABCG2MAPT
SCHEMBL3530093 0.77 EGFR (0.50) EGFRPDGFRBABCG2MAPTALDH1A1
SCHEMBL11083826 0.77 CSF1R (0.79) EGFRCSF1RPDGFRBPDGFRA
Hydrochloric Acid SCHEMBL11094140 0.76 CSF1R (0.77) EGFRCSF1RPDGFRBPDGFRA
SCHEMBL3109912 0.76 EGFR (1.00) EGFRCSF1RPDGFRBPDGFRA
SCHEMBL4586983 0.74 EGFR (0.55) EGFRCSF1RABCG2MEN1KMT2A
Hydrochloric Acid SCHEMBL6182107 0.74 EGFR (0.97) EGFRCSF1RPDGFRBPDGFRA

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
US-4464375-A ANALGESIC, ANTIINFLAMMATORY SANKYO CO., LTD. (JP) 1984-08-07 US disclosed
US-4322420-A Method of using 4-anilinoquinazoline derivatives as analgesic and anti-inflammatory agents SANKYO COMPANY LIMITED (JP) 1982-03-30 US disclosed