SCHEMBL6734044

SCHEMBL6734044

O=C(c1ncc(-c2cc[n+]([O-])cc2)cn1)N1CCN(S(=O)(=O)N2CCc3c(Cl)cccc3C2)CC1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
AKR1C3 P42330 2/20 0.41
AKR1C2 P52895 2/20 0.41
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
POLB P06746 2/20 0.38
MET P08581 3/20 0.37
CPT2 P23786 1/20 0.34
CPT1A P50416 1/20 0.34
AKR1C1 Q04828 1/20 0.34
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CNR1 P21554 2/20 0.33
NAMPT P43490 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HTR6 P50406 1/20 0.33

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
SCHEMBL6731711 0.88 LMNA (0.41) LMNASMN1; SMN2AKR1C3AKR1C2MEN1
SCHEMBL6730410 0.87 AKR1C3 (0.46) LMNASMN1; SMN2AKR1C3AKR1C2MEN1
SCHEMBL6725451 0.81 F10 (0.36) LMNAMEN1KMT2APOLBL3MBTL1
SCHEMBL6737632 0.77 MET (0.46) LMNASMN1; SMN2AKR1C3AKR1C2MEN1
SCHEMBL6729950 0.76 AKR1C3 (0.44) LMNASMN1; SMN2AKR1C3AKR1C2MEN1
SCHEMBL6737202 0.76 AKR1C3 (0.48) LMNASMN1; SMN2AKR1C3AKR1C2MEN1
SCHEMBL6725445 0.73 F10 (0.35) LMNAL3MBTL1ALDH1A1
SCHEMBL6734093 0.72 F10 (0.49) LMNASMN1; SMN2ALDH1A1
SCHEMBL6728467 0.72 POLB (0.34) LMNAPOLBMETL3MBTL1CNR1
SCHEMBL6726691 0.70 F10 (0.38) LMNAPOLBRAB9AL3MBTL1ALDH1A1

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 LMNA 1760/4885SMN1; SMN2 1510/4885AKR1C3 1221/4885

“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.