SCHEMBL6316647

SCHEMBL6316647

Cc1nn(-c2ccccc2)c(C)c1-c1noc(NC(=O)c2ccc(F)cc2F)c1C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.40
GAA P10253 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
P2RX7 Q99572 3/20 0.40
NR3C1 P04150 1/20 0.40
ALDH1A1 P00352 4/20 0.39
LMNA P02545 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
POLB P06746 2/20 0.39
NTRK1 P04629 3/20 0.39
TSHR P16473 1/20 0.39
KDM4E B2RXH2 1/20 0.38
WNT3A P56704 1/20 0.38

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
SCHEMBL6318278 0.87 HTT (0.44) GAANPSR1NR3C1ALDH1A1LMNA
SCHEMBL6316740 0.87 ALDH1A1 (0.46) SMN1; SMN2NPSR1ALDH1A1LMNANPC1
SCHEMBL6321867 0.85 WNT3A (0.41) SMN1; SMN2GAANPSR1ALDH1A1LMNA
SCHEMBL6315001 0.84 ALDH1A1 (0.44) SMN1; SMN2GAAP2RX7NR3C1ALDH1A1
SCHEMBL6315794 0.83 KDM4E (0.49) SMN1; SMN2GAANPSR1ALDH1A1LMNA
SCHEMBL6315445 0.82 WNT3A (0.43) SMN1; SMN2GAANPSR1LMNANPC1
SCHEMBL6322626 0.80 NPC1 (0.48) SMN1; SMN2NPSR1ALDH1A1LMNANPC1
SCHEMBL6316394 0.80 KMT2A (0.48) SMN1; SMN2NR3C1ALDH1A1LMNANPC1
SCHEMBL6315832 0.80 CA1 (0.43) SMN1; SMN2GAANPSR1NR3C1ALDH1A1
SCHEMBL6316791 0.80 ALDH1A1 (0.46) SMN1; SMN2NR3C1ALDH1A1LMNANPC1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2005-03-17 US claimed
US-6906185-B1 Derivatives of 7-deaza -2′-deoxyguanosine-5'-triphosphate, preparation and use thereof AMERSHAM BIOSCIENCES CORP. (US) 2005-06-14 US disclosed
US-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2005-03-17 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-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors MAP3K9, MAP3K19, MAP4K2 SMN1; SMN2 2766/4885GAA 789/4885NPSR1 4399/4885

“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.