SCHEMBL6415513

SCHEMBL6415513

O=C(O)c1ccc2ccc(F)cc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.52
BAD Q92934 1/20 0.52
KDM4E B2RXH2 5/20 0.48
CYP1A2 P05177 1/20 0.46
CYP2A6 P11509 1/20 0.46
ALDH1A1 P00352 3/20 0.46
HPGD P15428 3/20 0.46
HSD17B10 Q99714 3/20 0.46
TSHR P16473 2/20 0.46
LMNA P02545 2/20 0.46
PDPK1 O15530 1/20 0.46
NFKB1 P19838 1/20 0.46
APEX1 P27695 1/20 0.46
CYP2C19 P33261 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
HCAR1 Q9BXC0 1/20 0.45
PTPN1 P18031 2/20 0.45
ENPP2 Q13822 1/20 0.44
TP53 P04637 1/20 0.44
NR4A2 P43354 1/20 0.44

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
SCHEMBL29766531 0.94 KDM4E (0.55) BCL2L1BADKDM4ECYP1A2CYP2A6
SCHEMBL1285483 0.94 KDM4E (0.55) BCL2L1BADKDM4ECYP1A2CYP2A6
SCHEMBL28025 0.87 KDM4E (0.59) KDM4ECYP2A6ALDH1A1HPGDHSD17B10
SCHEMBL29406959 0.87 KDM4E (0.59) KDM4ECYP2A6ALDH1A1HPGDHSD17B10
SCHEMBL1769969 0.85 KDM4E (0.47) BCL2L1BADKDM4ECYP1A2CYP2A6
SCHEMBL8736492 0.84 KDM4E (0.63) KDM4ECYP2A6ALDH1A1HPGDHSD17B10
Hydrochloric Acid SCHEMBL9088279 0.84 KDM4E (0.57) KDM4ECYP2A6ALDH1A1HPGDHSD17B10
Terephthalic Acid SCHEMBL8964865 0.84 TSHR (0.63) KDM4ECYP2A6ALDH1A1HPGDHSD17B10
SCHEMBL31053172 0.84 KDM4E (0.57) KDM4ECYP2A6ALDH1A1HPGDHSD17B10
Hydrochloric Acid SCHEMBL1681904 0.84 KDM4E (0.57) KDM4ECYP2A6ALDH1A1HPGDHSD17B10

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050014789-A1 Amide derivatives as selective serotonin re-uptake inhibitors PFIZER INC 2005-01-20 US disclosed
WO-2004111003-A1 AMIDE DERIVATIVES AS SELECTIVE SEROTONIN RE-UPTAKE INHIBITORS PFIZER LIMITED (GB) 2004-12-23 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-20050014789-A1 Amide derivatives as selective serotonin re-uptake inhibitors SLC6A4, HTR3C, HTR3A BCL2L1 3087/4885BAD 1346/4885KDM4E 3765/4885

“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.