SCHEMBL6833875

SCHEMBL6833875

N#Cc1ccc(NC(=O)c2cncc(-c3ccc(C(F)(F)F)cc3)c2)c(C(=O)O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.52
MAPT P10636 1/20 0.52
SAE1 Q9UBE0 1/20 0.52
UBA2 Q9UBT2 1/20 0.52
KCNH2 Q12809 1/20 0.52
SCN10A Q9Y5Y9 1/20 0.52
XDH P47989 1/20 0.49
KDM1A O60341 3/20 0.47
HDAC1 Q13547 2/20 0.47
RXFP1 Q9HBX9 2/20 0.46
AAK1 Q2M2I8 2/20 0.45
ALB P02768 2/20 0.45
IGF2BP2 Q9Y6M1 1/20 0.44
NTRK1 P04629 1/20 0.43
CDK2 P24941 1/20 0.43
GAK O14976 1/20 0.43
STK16 O75716 1/20 0.43
PIM1 P11309 1/20 0.43
AXL P30530 1/20 0.43
NEK2 P51955 1/20 0.43

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
SCHEMBL6830649 0.90 KCNH2 (0.54) KDM4EMAPTSAE1UBA2KCNH2
SCHEMBL6833154 0.89 KDM4E (0.54) KDM4EMAPTSAE1UBA2KCNH2
SCHEMBL6833755 0.87 KCNH2 (0.55) KDM4EMAPTSAE1UBA2KCNH2
SCHEMBL6834140 0.87 SCN10A (0.54) KCNH2SCN10AXDHKDM1AHDAC1
SCHEMBL6834158 0.84 XDH (0.54) KDM4EMAPTSAE1UBA2KCNH2
SCHEMBL6834009 0.83 CTSA (0.47) KDM4EMAPTSAE1UBA2KCNH2
SCHEMBL6833253 0.79 GAK (0.46) KCNH2SCN10AXDHAAK1ALB
SCHEMBL6833179 0.79 ALDH1A1 (0.66) KDM4EMAPTALBNPC1RAB9A
SCHEMBL6357270 0.79 SERPINE1 (0.62) MAPTALBIGF2BP2KMT2A
SCHEMBL6830011 0.78 SERPINE1 (0.49) MAPTKCNH2SCN10AXDHAAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040110802-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-06-10 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-20040110802-A1 Antibacterial benzoic acid derivatives GABRD, GABBR1, GABRA1 KDM4E 1240/4885MAPT 4759/4885SAE1 1185/4885

“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.