SCHEMBL4282276

SCHEMBL4282276

CCc1ccc(Cl)cc1-c1cc(Cl)nc(N)n1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 11/20 0.60
HSP90AA1 P07900 10/20 0.60
ADCY10 Q96PN6 2/20 0.47
JAK2 O60674 1/20 0.46
KDM4E B2RXH2 1/20 0.45
AGPAT2 O15120 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL28043754 0.86 HSP90AB1 (0.62) HSP90AB1HSP90AA1ADCY10KDM4EAGPAT2
SCHEMBL13880351 0.81 AGPAT2 (0.72) AGPAT2
SCHEMBL4282884 0.80 AGPAT2 (0.67) HSP90AB1HSP90AA1JAK2KDM4EAGPAT2
SCHEMBL4281889 0.79 HSP90AB1 (0.75) HSP90AB1HSP90AA1KDM4EAGPAT2
SCHEMBL4286869 0.78 AGPAT2 (0.70) HSP90AB1HSP90AA1AGPAT2
SCHEMBL13880347 0.77 AGPAT2 (0.74) AGPAT2MEN1KMT2A
SCHEMBL4291570 0.76 HSP90AA1 (0.66) HSP90AB1HSP90AA1KDM4EAGPAT2SMN1; SMN2
SCHEMBL4280537 0.76 HSP90AA1 (0.71) HSP90AB1HSP90AA1KDM4EAGPAT2
SCHEMBL3944846 0.76 HSP90AB1 (1.00) HSP90AB1HSP90AA1KDM4EAGPAT2SMN1; SMN2
SCHEMBL30588697 0.75 HSP90AA1 (0.59) HSP90AB1HSP90AA1ADCY10KDM4ESMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090099183-A1 PYRIMIDINES AND USES THEREOF CELL THERAPEUTICS, INC. (US) 2009-04-16 US disclosed
US-7419984-B2 Pyrimidines and uses thereof CELL THERAPEUTICS, INC. (US) 2008-09-02 US disclosed
US-20040204386-A1 Pyrimidines and uses thereof CELL THERAPEUTICS, INC. 2004-10-14 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-20040204386-A1 Pyrimidines and uses thereof LPCAT3, LPCAT1, APRT HSP90AB1 4236/4885HSP90AA1 4126/4885ADCY10 1194/4885
US-20090099183-A1 PYRIMIDINES AND USES THEREOF LPCAT3, LPCAT1, APRT HSP90AB1 3829/4885HSP90AA1 4006/4885ADCY10 1120/4885

“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.