SCHEMBL680888

SCHEMBL680888

CC1CN(c2cc3nn(C4CCCCO4)cc3cc2Oc2ccc([N+](=O)[O-])cc2F)CCO1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ATR Q13535 2/20 0.36
FFAR2 O15552 1/20 0.34
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MITF O75030 1/20 0.32
RAB9A P51151 1/20 0.32
S1PR4 O95977 1/20 0.32
HSPB1 P04792 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
AKT1 P31749 1/20 0.31
BRAF P15056 1/20 0.31
KDR P35968 1/20 0.31
ATM Q13315 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL679716 1.00 ATR (0.36) ATRFFAR2ALDH1A1MAPTLMNA
SCHEMBL680000 0.93 ALDH1A1 (0.41) ALDH1A1MAPTLMNAGAASMN1; SMN2
SCHEMBL679194 0.88 RAB9A (0.32) ALDH1A1MAPTMITFRAB9AS1PR4
SCHEMBL679311 0.87 ATR (0.37) ATRFFAR2AKT1BRAFKDR
SCHEMBL679312 0.87 ATR (0.37) ATRFFAR2AKT1BRAFKDR
SCHEMBL680388 0.83 HSPB1 (0.36) ALDH1A1MAPTSMN1; SMN2RAB9AS1PR4
SCHEMBL679444 0.83 HSPB1 (0.36) ALDH1A1MAPTSMN1; SMN2RAB9AS1PR4
SCHEMBL680364 0.79 KDM4E (0.35) RAB9AKMT2A
SCHEMBL1547818 0.78 ATM (0.32) ATRAKT1ATM
SCHEMBL680593 0.76 AXL (0.37) ATRALDH1A1MAPTGAASMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE43878-E1 Amidophenoxyindazoles useful as inhibitors of c-Met ELI LILLY AND COMPANY (US) 2012-12-25 US disclosed
EP-2310382-B1 AMIDOPHENOXYINDAZOLES USEFUL AS INHIBITORS OF C-MET LILLY CO ELI (US) 2012-02-22 EP disclosed
US-8030302-B2 Amidophenoxyindazoles useful as inhibitors of c-Met ELI LILLY AND COMPANY (US) 2011-10-04 US disclosed
EP-2310382-A1 AMIDOPHENOXYINDAZOLES USEFUL AS INHIBITORS OF C-MET Eli Lilly & Company (US) 2011-04-20 EP disclosed
WO-2010011538-A1 AMIDOPHENOXYINDAZOLES USEFUL AS INHIBITORS OF C-MET ELI LILLY AND COMPANY (US) 2010-01-28 WO disclosed
US-20100022529-A1 AMIDOPHENOXYINDAZOLES USEFUL AS INHIBITORS OF C-MET ELI LILLY AND COMPANY 2010-01-28 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 (1 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-20100022529-A1 AMIDOPHENOXYINDAZOLES USEFUL AS INHIBITORS OF C-MET MET, MYCBP, MYC ATR 2993/4885FFAR2 2580/4885ALDH1A1 1450/4885

“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.