SCHEMBL6512498

SCHEMBL6512498

O=C(O)C(F)c1cc(Br)c(Oc2ccc3[nH]cc(S(=O)(=O)c4ccc(F)cc4)c3c2)c(Br)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.49
HTT P42858 3/20 0.49
LMNA P02545 2/20 0.49
KDM4E B2RXH2 2/20 0.47
MAPT P10636 3/20 0.45
MEN1 O00255 6/20 0.42
KMT2A Q03164 6/20 0.42
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
HDAC9 Q9UKV0 1/20 0.39
HDAC5 Q9UQL6 1/20 0.39
THRA P10827 4/20 0.38
THRB P10828 4/20 0.38

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
SCHEMBL6515988 0.92 SMN1; SMN2 (0.46) SMN1; SMN2HTTLMNAKDM4EMAPT
SCHEMBL6522323 0.91 SMN1; SMN2 (0.48) SMN1; SMN2HTTLMNAKDM4EMAPT
SCHEMBL6520124 0.91 SMN1; SMN2 (0.48) SMN1; SMN2HTTLMNAKDM4EMAPT
SCHEMBL6520118 0.91 SMN1; SMN2 (0.48) SMN1; SMN2HTTLMNAKDM4EMAPT
SCHEMBL6515875 0.90 SMN1; SMN2 (0.53) SMN1; SMN2HTTLMNAKDM4EMAPT
SCHEMBL6518585 0.89 SMN1; SMN2 (0.49) SMN1; SMN2HTTLMNAKDM4EMAPT
SCHEMBL6515796 0.87 SMN1; SMN2 (0.48) SMN1; SMN2HTTLMNAKDM4EMAPT
SCHEMBL6522316 0.85 SMN1; SMN2 (0.49) SMN1; SMN2HTTLMNAKDM4EMAPT
SCHEMBL6515785 0.85 SMN1; SMN2 (0.49) SMN1; SMN2HTTLMNAKDM4EMAPT
SCHEMBL6518581 0.85 LMNA (0.46) SMN1; SMN2HTTLMNAKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050032874-A1 Anticholesterol agents; arteriosclerosis BAYER AKTIENGESELLSCHAFT (DE) 2005-02-10 US disclosed
US-6794406-B2 FOR THERAPY AND PROPHYLAXIS OF ARTERIOSCLEROSIS AND HYPERCHOLESTEROLAEMIA BAYER AKTIENGESELLSCHAFT (DE) 2004-09-21 US disclosed
US-20030078288-A1 Indole derivatives BAYER AKTIENGESELLSCHAFT (DE) 2003-04-24 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 (2 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-20030078288-A1 Indole derivatives IDO1, IDO2, TPH2 SMN1; SMN2 4749/4885HTT 399/4885LMNA 3113/4885
US-20050032874-A1 Anticholesterol agents; arteriosclerosis HMGCR, CYP46A1, EBP SMN1; SMN2 4875/4885HTT 1524/4885LMNA 719/4885

“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.