SCHEMBL3010413

SCHEMBL3010413

CC(=O)Cc1cc(F)ccc1[N+](=O)[O-]

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
SNCA P37840 4/20 0.46
MAPT P10636 3/20 0.45
ALDH1A1 P00352 3/20 0.45
MAPK1 P28482 1/20 0.44
USP10 Q14694 1/20 0.41
USP7 Q93009 1/20 0.41
USP47 Q96K76 1/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CYP1A2 P05177 1/20 0.40
PDK1 Q15118 1/20 0.39
TTR P02766 1/20 0.39

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
SCHEMBL2994232 0.87 CYP1A2 (0.50) ATMTDP1MAPTALDH1A1MAPK1
SCHEMBL30410464 0.87 CYP1A2 (0.50) ATMTDP1MAPTALDH1A1MAPK1
SCHEMBL3396060 0.85 CYP1A2 (0.55) ATMTDP1SNCAMAPTALDH1A1
SCHEMBL26803674 0.84 ATM (0.49) ATMTDP1SNCAMAPTALDH1A1
SCHEMBL23200508 0.84 ATM (0.51) ATMTDP1SNCAMAPTALDH1A1
SCHEMBL1028874 0.83 PDGFRB (0.56) ATMTDP1SNCAMAPTALDH1A1
SCHEMBL30059615 0.83 ATM (0.47) ATMTDP1SNCAMAPTALDH1A1
SCHEMBL25245551 0.83 ATM (0.47) ATMTDP1SNCAMAPTALDH1A1
SCHEMBL29805390 0.83 MTNR1A (0.46) ATMTDP1SNCAMAPTALDH1A1
SCHEMBL11630295 0.83 NPC1 (0.56) ATMTDP1SNCAMAPTALDH1A1

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-20100197938-A1 Process for producing indole compoud NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-08-05 US disclosed
US-20070083053-A1 Process for producing indole compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2007-04-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100197938-A1 Process for producing indole compoud IDO1, IDO2, NOS2 ATM 2683/4885TDP1 3383/4885SNCA 821/4885
US-20070083053-A1 Process for producing indole compound IDO2, IDO1, TDO2 ATM 2602/4885TDP1 3755/4885SNCA 723/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.