SCHEMBL6736830

SCHEMBL6736830

CC(C)(C)[Si](OCCC1CN(S(=O)(=O)c2ccc3cc(Cl)ccc3c2)CCN1)(c1ccccc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.38
CXCR4 P61073 1/20 0.37
F10 P00742 11/20 0.37
AKR1C3 P42330 4/20 0.36
F2 P00734 2/20 0.36
AKR1C1 Q04828 1/20 0.36
LMNA P02545 1/20 0.35
MCOLN3 Q8TDD5 1/20 0.35

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
SCHEMBL6728681 0.85 F10 (0.39) CXCR4F10F2
SCHEMBL6737191 0.85 PPARG (0.41)
SCHEMBL6737189 0.80 F10 (0.41) F10AKR1C3F2AKR1C1LMNA
SCHEMBL6728509 0.78 HSD11B1 (0.35) PKMF10AKR1C3F2AKR1C1
SCHEMBL6737524 0.76 F10 (0.38) F10F2LMNA
SCHEMBL6198614 0.73 F10 (0.44) F10F2LMNA
Hydrochloric Acid SCHEMBL6734214 0.73 F10 (0.48) PKMCXCR4F10AKR1C3F2
SCHEMBL30857710 0.72 LTA4H (0.48) CXCR4
SCHEMBL29246127 0.72 SMYD2 (0.41)
SCHEMBL6731336 0.72 F10 (0.39) PKMCXCR4F10AKR1C3F2

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-6747023-B1 INHIBITORS FOR ACTIVATED COAGULATION FACTOR X, COAGULATION SUPPRESSORS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-06-08 US disclosed
US-20040082611-A1 Anticoagulants; brain disorders; respiratory system disorders; side effect reduction DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-04-29 US disclosed
EP-1104754-A1 NOVEL SULFONYL DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2001-06-06 EP 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 PKM 1374/4885CXCR4 3825/4885F10 19/4885

“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.