SCHEMBL6318549

SCHEMBL6318549

Nc1onc(-c2ccc(-c3cccc(Cl)c3)o2)c1C(=O)NCc1ccc(F)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPK1 P28482 1/20 0.45
MAPK10 P53779 1/20 0.45
KMT2A Q03164 2/20 0.42
ATM Q13315 1/20 0.42
POLB P06746 2/20 0.42
S1PR4 O95977 1/20 0.40
MAPT P10636 2/20 0.40
SLC9A1 P19634 1/20 0.40
MEN1 O00255 1/20 0.40
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
TP53 P04637 3/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA4 P22748 1/20 0.38
CA7 P43166 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
SCHEMBL6316611 0.92 RAB9A (0.48) RAB9AALDH1A1POLBS1PR4MAPT
SCHEMBL6316981 0.89 CYP1A2 (0.44) ALDH1A1KMT2APOLBMAPTSLC9A1
SCHEMBL6317733 0.88 RAB9A (0.45) RAB9AALDH1A1KMT2AATMPOLB
SCHEMBL6319272 0.87 RAB9A (0.42) RAB9AALDH1A1KMT2AATMPOLB
SCHEMBL6318222 0.87 ALDH1A1 (0.44) RAB9AALDH1A1KMT2APOLBS1PR4
SCHEMBL6317377 0.87 LMNA (0.48) RAB9AALDH1A1KMT2AMAPTMEN1
SCHEMBL6317315 0.87 CA1 (0.51) KMT2AATMTP53CA1CA2
SCHEMBL6320762 0.86 HCRTR1 (0.51) RAB9AALDH1A1MAPK1KMT2AMAPT
SCHEMBL6316618 0.86 TACR1 (0.46) RAB9AALDH1A1POLBGAA
SCHEMBL6318194 0.86 MEN1 (0.53) RAB9AALDH1A1MAPK1MAPK10KMT2A

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 7 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
CN-1549714-A Aminoisoxazole derivatives active as kinase inhibitors 2004-11-24 CN claimed
EP-1435948-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2004-07-14 EP claimed
WO-2003013517-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS PHARMACIA ITALIA S.P.A. (IT) 2003-02-20 WO claimed
US-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2005-03-17 US disclosed
EP-1435948-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2004-07-14 EP disclosed
WO-2003013517-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS PHARMACIA ITALIA S.P.A. (IT) 2003-02-20 WO 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 RAB9A 1754/4885ALDH1A1 4444/4885MAPK1 178/4885

“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.