SCHEMBL6323447

SCHEMBL6323447

COc1ccc(-c2noc(N)c2C(=O)NCCC(c2ccccc2)c2ccccc2)cn1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 7/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
GABRA1 P14867 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
GABRA5 P31644 2/20 0.42
LMNA P02545 2/20 0.41
HPGD P15428 1/20 0.41
CD274 Q9NZQ7 1/20 0.41
POLB P06746 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL6618320 0.93 RIPK1 (0.45) GABRA1MAPK1GABRA5LMNACD274
SCHEMBL6316178 0.88 GABRA1 (0.47) GABRA1SMN1; SMN2MAPK1GABRA5LMNA
SCHEMBL6324006 0.87 MAPT (0.48) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL6317605 0.85 L3MBTL1 (0.57) MEN1KMT2AALDH1A1MAPTGABRA5
SCHEMBL6324039 0.84 ALDH1A1 (0.52) MEN1KMT2AGABRA1ALDH1A1MAPT
SCHEMBL6315938 0.84 GABRA1 (0.45) KMT2AGABRA1ALDH1A1MAPK1GABRA5
SCHEMBL6324304 0.84 L3MBTL1 (0.53) MEN1KMT2AALDH1A1MAPTGABRA5
SCHEMBL6321552 0.83 MAPK1 (0.52) MEN1KMT2AGABRA1ALDH1A1MAPK1
SCHEMBL6315289 0.83 RAB9A (0.46) MEN1KMT2AGABRA1SMN1; SMN2MAPK1
SCHEMBL6323798 0.82 GAA (0.45) MEN1KMT2AGABRA1SMN1; SMN2MAPK1

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-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2005-03-17 US claimed
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 EPHX2 4156/4885MEN1 2789/4885KMT2A 1089/4885

“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.