SCHEMBL6352408

SCHEMBL6352408

O=C(Nc1ccc(Br)cc1C(=O)O)c1cc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)c(F)cc1Cl

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.55
RAB9A P51151 8/20 0.55
KMT2A Q03164 4/20 0.47
RPA1 P27694 1/20 0.44
MEN1 O00255 3/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
TP53 P04637 2/20 0.42
HPGD P15428 1/20 0.42
MIF P14174 1/20 0.41
LMNA P02545 3/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
MAPT P10636 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
SCHEMBL6360706 0.87 RPA1 (0.50) KMT2ARPA1MEN1TP53MIF
SCHEMBL6353696 0.81 PTGES (0.56) NPC1RAB9AKMT2ARPA1MEN1
SCHEMBL6351810 0.80 KMT2A (0.52) KMT2AMEN1SMN1; SMN2TP53HPGD
SCHEMBL6353699 0.79 RAB9A (0.56) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL6437241 0.79 RPA1 (0.64) NPC1RAB9AKMT2ARPA1MEN1
SCHEMBL6833237 0.79 RAB9A (0.45) NPC1RAB9AKMT2ARPA1MEN1
SCHEMBL6833850 0.79 RAB9A (0.45) NPC1RAB9AKMT2ARPA1MEN1
SCHEMBL6357750 0.78 POLB (0.59) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL6830408 0.78 SMN1; SMN2 (0.48) NPC1RAB9AKMT2ARPA1MEN1
SCHEMBL6358855 0.77 MAPT (0.57) NPC1RAB9AKMT2ARPA1MEN1

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-20050113450-A1 Antibacterial agents PHARMACIA & UPJOHN COMPANY 2005-05-26 US claimed

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-20050113450-A1 Antibacterial agents CLPP, SPOUT1, SAMHD1 NPC1 3512/4885RAB9A 3062/4885KMT2A 3645/4885

“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.