SCHEMBL6730945

SCHEMBL6730945

NCc1cccc(-c2ncc(C(=O)N3CCN(S(=O)(=O)c4nc5cc(Cl)ccc5[nH]4)CC3)cn2)n1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F10 P00742 8/20 0.40
KLK1 P06870 1/20 0.38
LMNA P02545 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GAA P10253 1/20 0.36
OPRM1 P35372 1/20 0.36
CNR1 P21554 1/20 0.36
THRB P10828 1/20 0.36
ALDH1A1 P00352 1/20 0.35
MGLL Q99685 1/20 0.35
HTR1A P08908 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
SCHEMBL6730938 0.94 F10 (0.41) F10KLK1LMNAL3MBTL1GAA
SCHEMBL6726632 0.93 F10 (0.40) F10KLK1LMNAL3MBTL1GAA
SCHEMBL6783011 0.91 F10 (0.39) F10KLK1LMNAL3MBTL1GAA
SCHEMBL6728618 0.89 F10 (0.46) F10KLK1LMNA
SCHEMBL6728563 0.88 F10 (0.37) F10KLK1LMNAL3MBTL1GAA
SCHEMBL6730500 0.88 F10 (0.42) F10KLK1LMNAL3MBTL1OPRM1
SCHEMBL6726550 0.87 LMNA (0.45) F10KLK1LMNAL3MBTL1GAA
SCHEMBL6730681 0.86 F10 (0.56) F10KLK1OPRM1
SCHEMBL6726628 0.86 HRH4 (0.41) F10KLK1LMNAL3MBTL1GAA
SCHEMBL6729644 0.85 F10 (0.42) F10KLK1LMNAL3MBTL1OPRM1

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 F10 19/4885KLK1 3139/4885LMNA 1760/4885

“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.