SCHEMBL3766633

SCHEMBL3766633

COc1ccc(NC(C)=O)cc1Cc1cccc(C(F)(F)F)c1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.60
SMN1; SMN2 Q16637 6/20 0.52
LMNA P02545 2/20 0.52
SCD O00767 3/20 0.52
HTT P42858 3/20 0.51
TSHR P16473 2/20 0.50
MAPK1 P28482 1/20 0.50
RXFP1 Q9HBX9 2/20 0.48
KDM4E B2RXH2 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
MPO P05164 1/20 0.47
MAPT P10636 1/20 0.46
THRB P10828 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL3780422 0.78 KMT2A (0.44) POLBSMN1; SMN2LMNASCDHTT
SCHEMBL5132080 0.74 CYP19A1 (0.49) SMN1; SMN2LMNAHTTKDM4ETDP1
SCHEMBL5952426 0.74 ALDH1A1 (0.59) POLBSMN1; SMN2LMNAHTTMAPK1
SCHEMBL505220 0.74 RXFP1 (0.69) SMN1; SMN2LMNAHTTRXFP1KDM4E
SCHEMBL30022965 0.74 RXFP1 (0.69) SMN1; SMN2LMNAHTTRXFP1KDM4E
SCHEMBL2647267 0.73 SMN1; SMN2 (0.63) POLBSMN1; SMN2LMNAHTTTSHR
SCHEMBL7751896 0.72 ALDH1A1 (0.56) POLBSMN1; SMN2LMNAHTTMAPK1
SCHEMBL26657545 0.71 IDH1 (0.66) POLB
SCHEMBL2647658 0.71 SMN1; SMN2 (0.63) POLBSMN1; SMN2LMNAHTTTSHR
SCHEMBL5000568 0.71 PTGDR2 (0.47) LMNASCDTDP1MAPT

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
EP-2443092-B1 BICYCLIC AND TRICYCLIC COMPOUNDS AS KAT II INHIBITORS PFIZER (US) 2015-04-08 EP disclosed
US-8183238-B2 Bicyclic and tricyclic compounds as KAT II inhibitors PFIZER INC. (US) 2012-05-22 US disclosed
US-20100324043-A1 Bicyclic And Tricyclic Compounds As KAT II Inhibitors PFIZER INC 2010-12-23 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-20100324043-A1 Bicyclic And Tricyclic Compounds As KAT II Inhibitors KAT2A, KAT2B, KAT6B POLB 287/4885SMN1; SMN2 3284/4885LMNA 4123/4885

“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.