SCHEMBL6943845

SCHEMBL6943845

NC(=O)C1CCC(Nc2ccc([N+](=O)[O-])cc2C(=O)NCc2ccc3c(c2)OCO3)CC1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.57
MAPT P10636 5/20 0.57
SMN1; SMN2 Q16637 3/20 0.52
KMT2A Q03164 4/20 0.51
MEN1 O00255 3/20 0.51
TDP1 Q9NUW8 2/20 0.50
HPGD P15428 1/20 0.50
GAA P10253 1/20 0.49
POLB P06746 2/20 0.49
LMNA P02545 1/20 0.47
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL6943733 0.92 MAPT (0.58) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL6944924 0.92 ALDH1A1 (0.60) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL6944931 0.92 ALDH1A1 (0.60) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL6941990 0.90 MAPT (0.60) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL6939374 0.90 MAPT (0.60) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL6939369 0.90 MAPT (0.60) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL6940658 0.90 MAPT (0.64) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL6943217 0.90 MAPT (0.56) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL6946648 0.88 MAPT (0.59) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL6946578 0.88 MAPT (0.59) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1

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 253/4885MAPT 4706/4885SMN1; SMN2 3616/4885

“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.