SCHEMBL4409462

SCHEMBL4409462

COc1cc2nc(Cl)nc(-c3ccccc3F)c2cc1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ WHR1 P49842 1/20 0.47
▸ EGFR P00533 5/20 0.44
▸ KDR P35968 4/20 0.44
▸ KIT P10721 1/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ HTT P42858 1/20 0.43
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ EHMT2 Q96KQ7 1/20 0.42
▸ FLT1 P17948 1/20 0.41
▸ NQO2 P16083 1/20 0.41
▸ KLK7 P49862 2/20 0.41
▸ KLK14 Q9P0G3 2/20 0.41
▸ KLK5 Q9Y337 2/20 0.41
▸ CTSG P08311 1/20 0.41

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
SCHEMBL7791033 0.84 ADORA2A (0.61) WHR1EGFRKITMEN1KMT2A
SCHEMBL27117037 0.80 WHR1 (0.71) WHR1EGFRKDRSMN1; SMN2ALDH1A1
SCHEMBL3774502 0.77 LMNA (0.48) SMN1; SMN2ALDH1A1KMT2ALMNATP53
SCHEMBL6667126 0.77 PDGFRB (0.56) WHR1EGFRKDRKITSMN1; SMN2
SCHEMBL27117048 0.77 PDGFRB (0.47) WHR1EGFRKDRSMN1; SMN2ALDH1A1
SCHEMBL3772243 0.76 ADORA2A (0.66) ALDH1A1LMNAPOLBMAPT
SCHEMBL1941112 0.76 WHR1 (0.60) WHR1EGFRKDRSMN1; SMN2ALDH1A1
SCHEMBL1942856 0.75 WHR1 (0.56) WHR1EGFRKDRSMN1; SMN2ALDH1A1
SCHEMBL4404867 0.75 KDM4E (0.60) WHR1ALDH1A1KMT2ALMNAPOLB
SCHEMBL7799239 0.74 ADORA2A (0.51) WHR1EGFRKITMEN1KMT2A

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-20090162286-A1 Phosphodiesterase 10 Inhibition as Treatment for Obesity-Related and Metabolic Syndrome-Related Conditions PFIZER INC. 2009-06-25 — — US disclosed
EP-1755611-A1 PHOSPHODIESTERASE 10 INHIBITION AS TREATMENT FOR OBESITY-RELATED AND METABOLIC SYNDROME-RELATED CONDITIONS Pfizer Products Inc. (US) 2007-02-28 — — EP disclosed
WO-2005120514-A1 PHOSPHODIESTERASE 10 INHIBITION AS TREATMENT FOR OBESITY-RELATED AND METABOLIC SYNDROME-RELATED CONDITIONS PFIZER PRODUCTS INC. (US) 2005-12-22 — — 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-20090162286-A1 Phosphodiesterase 10 Inhibition as Treatment for Obesity-Related and Metabolic Syndrome-Related Conditions PDE5A, PDE12, PDE2A WHR1 1618/4885EGFR 4837/4885KDR 2604/4885

“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.

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