SCHEMBL6353699

SCHEMBL6353699

O=C(Nc1ccc(Br)cc1C(=O)O)c1ccc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)cc1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.56
NPC1 O15118 3/20 0.56
LMNA P02545 3/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
KMT2A Q03164 4/20 0.53
MEN1 O00255 3/20 0.53
MAOB P27338 1/20 0.51
ALDH1A1 P00352 2/20 0.50
KDM4E B2RXH2 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
METAP2 P50579 2/20 0.49
TSHR P16473 1/20 0.49

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
SCHEMBL6353681 0.90 KMT2A (0.64) RAB9ANPC1LMNASMN1; SMN2KMT2A
SCHEMBL6351810 0.89 KMT2A (0.52) LMNASMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL6353696 0.88 PTGES (0.56) RAB9ANPC1LMNASMN1; SMN2KMT2A
SCHEMBL6357750 0.87 POLB (0.59) RAB9ANPC1LMNASMN1; SMN2KMT2A
SCHEMBL6437241 0.86 RPA1 (0.64) RAB9ANPC1LMNASMN1; SMN2KMT2A
SCHEMBL6830408 0.85 SMN1; SMN2 (0.48) RAB9ANPC1LMNASMN1; SMN2KMT2A
SCHEMBL6349460 0.85 MEN1 (0.60) KMT2AMEN1METAP2
SCHEMBL6358855 0.84 MAPT (0.57) RAB9ANPC1LMNASMN1; SMN2KMT2A
SCHEMBL6350610 0.82 MEN1 (0.69) KMT2AMEN1METAP2
SCHEMBL6348358 0.82 METAP2 (0.71) LMNASMN1; SMN2KMT2AMEN1ALDH1A1

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-20050113450-A1 Antibacterial agents PHARMACIA & UPJOHN COMPANY 2005-05-26 US claimed
WO-2004018414-A2 ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2004-03-04 WO 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 RAB9A 3062/4885NPC1 3512/4885LMNA 4552/4885

“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.