SCHEMBL3544600

SCHEMBL3544600

COC(=O)c1cccc(SCC(F)(F)F)c1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.48
MRGPRX4 Q96LA9 4/20 0.47
CYP4F2 P78329 2/20 0.47
CYP4A11 Q02928 2/20 0.47
TSHR P16473 1/20 0.43
SDHB P21912 1/20 0.43
POLB P06746 1/20 0.42
RAB9A P51151 1/20 0.42
NOTUM Q6P988 1/20 0.42
APEX1 P27695 1/20 0.42
TP53 P04637 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SLC7A5 Q01650 1/20 0.42
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
KMT2A Q03164 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
SCHEMBL3544629 0.81 APEX1 (0.63) MRGPRX4POLBAPEX1KMT2A
SCHEMBL30633020 0.80 PARP1 (0.47) MRGPRX4TSHRPOLBAPEX1MEN1
SCHEMBL17714287 0.80 LOXL2 (0.47) LOXL2MRGPRX4CYP4F2CYP4A11TSHR
SCHEMBL670864 0.79 APEX1 (0.51) LOXL2CYP4F2CYP4A11TSHRPOLB
SCHEMBL28169965 0.79 NOTUM (0.48) LOXL2MRGPRX4CYP4F2CYP4A11TSHR
SCHEMBL21415466 0.78 TSHR (0.52) LOXL2MRGPRX4CYP4F2CYP4A11TSHR
SCHEMBL17048425 0.78 MTNR1A (0.49) LOXL2CYP4F2CYP4A11TSHRPOLB
SCHEMBL3542535 0.78 SDHB (0.46) LOXL2MRGPRX4CYP4F2CYP4A11TSHR
SCHEMBL6618421 0.78 LOXL2 (0.49) LOXL2CYP4F2CYP4A11TSHRPOLB
SCHEMBL29571134 0.77 CYP1A2 (0.60) LOXL2CYP4F2CYP4A11TSHRPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7691843-B2 N-hydroxyamide derivatives possessing antibacterial activity PFIZER INC. (US) 2010-04-06 US disclosed
US-20080058304-A1 N-hydroxyamide derivatives possessing antibacterial activity VICURON HOLDINGS LLC 2008-03-06 US disclosed
EP-1539744-A4 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARM INC (US) 2007-06-06 EP disclosed
EP-1539744-A2 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY Vicuron Pharmaceuticals, Inc. (US) 2005-06-15 EP disclosed
WO-2004007444-A2 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS, INC. (US) 2004-01-22 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-20080058304-A1 N-hydroxyamide derivatives possessing antibacterial activity AMDHD2, OGA, ENGASE LOXL2 1637/4885MRGPRX4 4001/4885CYP4F2 4455/4885

“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.