SCHEMBL6943992

SCHEMBL6943992

COc1ccc(CNC(=O)c2cc(S(=O)(=O)N3CCNCC3)ccc2N[C@H]2CC[C@H](O)CC2)cc1OC

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
RAB9A P51151 1/20 0.51
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
GAA P10253 2/20 0.44
POLB P06746 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
TGM2 P21980 1/20 0.43
NPC1 O15118 1/20 0.42
HTT P42858 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL6943987 1.00 ALDH1A1 (0.54) ALDH1A1RAB9AKMT2AMEN1GAA
SCHEMBL6941969 0.87 ALDH1A1 (0.50) ALDH1A1RAB9AKMT2AMEN1GAA
SCHEMBL6941967 0.87 ALDH1A1 (0.50) ALDH1A1RAB9AKMT2AMEN1GAA
SCHEMBL6941312 0.80 MEN1 (0.44) ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL6941310 0.80 MEN1 (0.44) ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL6937261 0.78 GABRP (0.51) ALDH1A1KMT2AMEN1SMN1; SMN2L3MBTL1
SCHEMBL6937265 0.78 GABRP (0.51) ALDH1A1KMT2AMEN1SMN1; SMN2L3MBTL1
SCHEMBL6939423 0.78 GABRP (0.51) ALDH1A1KMT2AMEN1SMN1; SMN2L3MBTL1
SCHEMBL6941731 0.78 APEX1 (0.45) ALDH1A1KMT2APOLBSMN1; SMN2
SCHEMBL6941738 0.78 APEX1 (0.45) ALDH1A1KMT2APOLBSMN1; SMN2

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
EP-1080069-B1 ANTHRANILIC ACID DERIVATIVES AS INHIBITORS OF THE CGMP-PHOSPHODIESTERASE FUJISAWA PHARMACEUTICAL CO (JP) 2003-03-19 EP disclosed
US-20020193614-A1 Anthranilic acid derivatives as inhibitors of the CGMP-phosphodiesterase FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2002-12-19 US disclosed
US-6384080-B1 TREATMENT AND/OR PREVENTION OF CERTAIN CARDIOVASCULAR DISORDERS, UROGENITAL DISORDERS, RESPIRATORY SYSTEM DISORDERS, DISORDERS OF GUT MOTILITY, SEXUAL DISORDERS, DIABETIC COMPLICATIONS, URTICARIA FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-05-07 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-20020193614-A1 Anthranilic acid derivatives as inhibitors of the CGMP-phosphodiesterase PDE3A, PDE2A, PDE5A ALDH1A1 253/4885RAB9A 1299/4885KMT2A 1991/4885

“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.