SCHEMBL7261935

SCHEMBL7261935

O=[N+]([O-])c1cc(NCn2nnc3ccccc32)ccc1F

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RPS6KA3 P51812 1/20 0.53
▸ MEN1 O00255 4/20 0.45
▸ KMT2A Q03164 4/20 0.45
▸ MAPT P10636 4/20 0.45
▸ LMNA P02545 3/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ HTT P42858 2/20 0.45
▸ ABCG2 Q9UNQ0 1/20 0.45
▸ ALDH1A1 P00352 6/20 0.44
▸ ALDH3A1 P30838 1/20 0.44
▸ GAA P10253 3/20 0.44
▸ MGAM O43451 1/20 0.44
▸ AMY1A P0DUB6 1/20 0.44
▸ SI P14410 1/20 0.44
▸ MGAM2 Q2M2H8 1/20 0.44
▸ ATM Q13315 1/20 0.44
▸ CYP1A2 P05177 2/20 0.43
▸ CYP2C9 P11712 2/20 0.43
▸ CYP2C19 P33261 2/20 0.43
▸ POLB P06746 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
SCHEMBL27890010 0.80 RPS6KA3 (0.64) RPS6KA3MEN1KMT2AMAPTALDH1A1
SCHEMBL9618157 0.76 RPS6KA3 (0.84) RPS6KA3MAPTALDH1A1CYP1A2CYP2C9
SCHEMBL4590984 0.75 RPS6KA3 (0.59) RPS6KA3KMT2AMAPTALDH1A1CYP1A2
SCHEMBL2490946 0.73 RPS6KA3 (0.73) RPS6KA3KMT2AMAPTLMNASMN1; SMN2
SCHEMBL2494276 0.72 RPS6KA3 (0.59) RPS6KA3ALDH1A1GAAMGAMAMY1A
SCHEMBL2494163 0.72 RPS6KA3 (0.77) RPS6KA3MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL2490332 0.71 GRM2 (0.52) RPS6KA3ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL7128898 0.71 HTR6 (0.62) MEN1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL22375107 0.70 RPS6KA3 (1.00) RPS6KA3MEN1KMT2AMAPTLMNA
SCHEMBL3342201 0.70 RPS6KA3 (0.73) RPS6KA3MEN1KMT2ALMNASMN1; SMN2

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-6653353-B2 Hair styling anionic polymer and fluoroamines mixture improves the holding power of styling resins under high humidity conditions UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-11-25 — — US disclosed
US-20020176834-A1 Cosmetic and personal care compositions UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-11-28 — — US disclosed
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