SCHEMBL6834021

SCHEMBL6834021

O=C(O)c1cc(Br)ccc1NC(=O)c1ccnc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.54
KDM4E B2RXH2 1/20 0.54
AKR1C2 P52895 2/20 0.52
AKR1C1 Q04828 2/20 0.52
AKR1C4 P17516 1/20 0.52
AKR1C3 P42330 1/20 0.52
SORT1 Q99523 4/20 0.51
KMT2A Q03164 5/20 0.49
MEN1 O00255 4/20 0.49
GFER P55789 2/20 0.49
ACLY P53396 1/20 0.48
TP53 P04637 1/20 0.48
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
ABL1 P00519 1/20 0.46
TSHR P16473 1/20 0.46
RIN1 Q13671 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CNR1 P21554 1/20 0.46
CNR2 P34972 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
SCHEMBL6830501 0.81 KMT2A (0.76) MAPTKDM4EKMT2AMEN1GFER
SCHEMBL1307732 0.80 GFER (0.76) MAPTKDM4EAKR1C2AKR1C1AKR1C4
SCHEMBL6834682 0.78 SORT1 (0.60) MAPTAKR1C2AKR1C1AKR1C4AKR1C3
SCHEMBL6359676 0.78 AKR1C2 (0.55) MAPTKDM4EAKR1C2AKR1C1AKR1C4
SCHEMBL6818060 0.77 AKR1C2 (0.51) MAPTKDM4EAKR1C2AKR1C1AKR1C4
SCHEMBL1308673 0.76 AKR1C2 (0.62) MAPTKDM4EAKR1C2AKR1C1AKR1C4
SCHEMBL379808 0.76 CYP3A4 (0.60) MAPTKMT2AMEN1ACLYALDH1A1
SCHEMBL9513479 0.76 MAPT (0.80) MAPTAKR1C2AKR1C1AKR1C4AKR1C3
SCHEMBL6834036 0.76 SMN1; SMN2 (0.58) MAPTKDM4EAKR1C2AKR1C1AKR1C4
SCHEMBL24688078 0.75 RXFP1 (0.58) MAPTKMT2AALDH1A1LMNA

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 MAPT 4759/4885KDM4E 1240/4885AKR1C2 2596/4885

“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.