SCHEMBL5774733

SCHEMBL5774733

CCCCS(=O)(=O)c1cc(OC)cc(F)c1C(=O)n1ccnc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP24A1 Q07973 2/20 0.36
CCNB2 O95067 1/20 0.35
CCNE2 O96020 1/20 0.35
CDK1 P06493 1/20 0.35
CDK4 P11802 1/20 0.35
CCNB1 P14635 1/20 0.35
CCND1 P24385 1/20 0.35
CCNE1 P24864 1/20 0.35
CDK2 P24941 1/20 0.35
CCND2 P30279 1/20 0.35
CCND3 P30281 1/20 0.35
CCNB3 Q8WWL7 1/20 0.35
KMT2A Q03164 1/20 0.33
CYP19A1 P11511 2/20 0.32
AGTR2 P50052 3/20 0.31
NAAA Q02083 1/20 0.31
AHR P35869 1/20 0.31
TSHR P16473 2/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL5775261 0.81 PTGES (0.43) CCNB2CCNE2CDK1CDK4CCNB1
SCHEMBL5776178 0.76 CCNB2 (0.36) CCNB2CCNE2CDK1CDK4CCNB1
SCHEMBL11110140 0.65 CYP19A1 (0.55) KMT2ACYP19A1TSHRALDH1A1MAPT
SCHEMBL27595293 0.65 KMT2A (0.34) CYP24A1CDK4CDK2KMT2ACYP19A1
SCHEMBL11259049 0.63 THRA (0.34) CYP19A1AHRSMN1; SMN2
SCHEMBL4815855 0.62 KDM4E (0.53) CYP19A1TSHRALDH1A1MAPTTBXAS1
SCHEMBL7527268 0.62 MAPT (0.41) CYP24A1KMT2ACYP19A1TSHRALDH1A1
SCHEMBL20314696 0.61 L3MBTL1 (0.54) TSHRALDH1A1MAPTSMN1; SMN2
SCHEMBL31388161 0.61 GRM5 (0.42) CYP19A1ALDH1A1MAPTSMN1; SMN2TBXAS1
SCHEMBL27876389 0.61 TBXAS1 (0.35) CYP19A1AHRSMN1; SMN2NAMPTTBXAS1

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-1483257-B1 QUINAZOLINE COMPOUNDS USEFUL IN THERAPY PFIZER LTD (GB) 2006-09-13 EP disclosed
US-6936619-B2 Cardiovascular disorders; antilipemic agents; sexual disorders PFIZER, INC. (US) 2005-08-30 US disclosed
US-20040029859-A1 Compounds useful in therapy PFIZER INC. 2004-02-12 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-20040029859-A1 Compounds useful in therapy ADRA1D, HSD3B1, PTGER1 CYP24A1 129/4885CCNB2 3287/4885CCNE2 1253/4885

“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.