SCHEMBL6738660

SCHEMBL6738660

O=C(c1ccc(-c2ccncc2)cc1)N1CCN(S(=O)(=O)c2nc3cc(Cl)ccc3[nH]2)CC1.O=C(c1ccc(-c2ccncc2)cc1)N1CCN(S(=O)(=O)c2nc3ccc(Cl)cc3[nH]2)CC1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F10 P00742 10/20 0.49
KLK1 P06870 1/20 0.49
LSS P48449 1/20 0.46
ALDH1A1 P00352 1/20 0.45
HRH4 Q9H3N8 1/20 0.44
HRH3 Q9Y5N1 1/20 0.44
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.41
LMNA P02545 1/20 0.41
HTR2B P41595 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALOX15 P16050 1/20 0.40

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
SCHEMBL6421218 0.96 F10 (0.51) F10KLK1LSSALDH1A1HRH4
SCHEMBL6421211 0.96 F10 (0.51) F10KLK1LSSALDH1A1ATM
SCHEMBL6729562 0.88 HTR2B (0.52) F10KLK1HRH4HRH3HTR2B
SCHEMBL6734491 0.86 ALDH1A1 (0.46) F10KLK1ALDH1A1HRH4HRH3
SCHEMBL6734496 0.86 ALDH1A1 (0.44) F10KLK1LSSALDH1A1ATM
SCHEMBL6731390 0.86 F10 (0.49) F10KLK1L3MBTL1MEN1KMT2A
SCHEMBL6731383 0.86 F10 (0.49) F10KLK1HRH4HRH3L3MBTL1
SCHEMBL6731719 0.85 F10 (0.49) F10KLK1HRH4HRH3L3MBTL1
SCHEMBL6731715 0.85 F10 (0.49) F10KLK1MEN1KMT2A
SCHEMBL6731532 0.85 ALDH1A1 (0.46) F10KLK1ALDH1A1HRH4HRH3

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-20040082611-A1 Anticoagulants; brain disorders; respiratory system disorders; side effect reduction DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-04-29 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-20040082611-A1 Anticoagulants; brain disorders; respiratory system disorders; side effect reduction F2, CYC1, SULT2A1 F10 19/4885KLK1 3139/4885LSS 1745/4885

“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.