SCHEMBL10285155

SCHEMBL10285155

CCc1nn(CCNC(=O)OC(C)(C)C)c(CO)c1Oc1cc(Cl)cc(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.38
MAPT P10636 2/20 0.36
BRD4 O60885 2/20 0.34
P2RX3 P56373 1/20 0.34
IDO1 P14902 2/20 0.33
CCNB2 O95067 1/20 0.33
CCNE2 O96020 1/20 0.33
CDK1 P06493 1/20 0.33
CDK4 P11802 1/20 0.33
CCNB1 P14635 1/20 0.33
CCND1 P24385 1/20 0.33
CCNE1 P24864 1/20 0.33
CDK2 P24941 1/20 0.33
CCNB3 Q8WWL7 1/20 0.33
ALDH1A1 P00352 2/20 0.33
EPAS1 Q99814 1/20 0.33
TP53 P04637 1/20 0.33
GLA P06280 1/20 0.33
HPGD P15428 1/20 0.33
XBP1 P17861 1/20 0.33

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
SCHEMBL10285114 0.91 DRD2 (0.37) DRD2MAPTBRD4P2RX3IDO1
SCHEMBL10285154 0.91 DRD2 (0.37) DRD2MAPTBRD4P2RX3IDO1
SCHEMBL14540478 0.91 DRD2 (0.37) DRD2MAPTBRD4P2RX3IDO1
SCHEMBL10285523 0.90 DRD2 (0.36) DRD2MAPTBRD4P2RX3IDO1
SCHEMBL509867 0.87 MAPT (0.40) MAPTALDH1A1PTGDR2SMN1; SMN2
SCHEMBL10285187 0.87 DRD2 (0.34) DRD2MAPTBRD4P2RX3IDO1
SCHEMBL10285156 0.86 DRD2 (0.34) DRD2MAPTBRD4P2RX3CCNB2
SCHEMBL10285153 0.84 DRD2 (0.38) DRD2ALDH1A1
SCHEMBL10285159 0.84 BRD4 (0.36) DRD2BRD4P2RX3PTGDR2
SCHEMBL10285742 0.82 CACNA1G (0.35) DRD2MAPTBRD4P2RX3CCNB2

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-20120029192-A1 Pyrazole Derivatives PFIZER INC 2012-02-02 US disclosed
US-8063044-B2 Pyrazole derivatives PFIZER INC. (US) 2011-11-22 US disclosed
US-8063044-B2 Pyrazole derivatives PFIZER INC. (US) 2011-11-22 US disclosed
US-20090215712-A1 PYRAZOLE DERIVATIVES PFIZER INC 2009-08-27 US disclosed
US-20090215712-A1 PYRAZOLE DERIVATIVES PFIZER INC 2009-08-27 US disclosed
US-7435728-B2 Pyrazole derivatives PFIZER INC (US) 2008-10-14 US disclosed
US-7435728-B2 Pyrazole derivatives PFIZER INC (US) 2008-10-14 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-20090215712-A1 PYRAZOLE DERIVATIVES RRM2B, REV1, RRM2 DRD2 2492/4885MAPT 2220/4885BRD4 864/4885
US-20120029192-A1 Pyrazole Derivatives POLRMT, PDCD11, DPYD DRD2 2472/4885MAPT 1474/4885BRD4 943/4885

“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.