SCHEMBL6135097

SCHEMBL6135097

COCCCCOCC1CCN(c2ccc(-c3nn4cc(-c5ccc(C(=O)O)cc5)nc4s3)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.45
TP53 P04637 3/20 0.45
LMNA P02545 2/20 0.45
CA12 O43570 4/20 0.40
CA1 P00915 4/20 0.40
CA2 P00918 4/20 0.40
CA9 Q16790 4/20 0.40
CHEK1 O14757 1/20 0.38
POLB P06746 1/20 0.37
USP2 O75604 1/20 0.37
GAA P10253 1/20 0.37

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
Hydrochloric Acid SCHEMBL6135061 0.98 MAPT (0.44) MAPTTP53LMNACA12CA1
SCHEMBL6134866 0.91 MAPT (0.44) MAPTTP53LMNACA12CA1
SCHEMBL6132169 0.89 MAPT (0.43) MAPTTP53LMNACA12CA1
Trifluoroacetic Acid SCHEMBL6134395 0.87 MAPT (0.42) MAPTTP53LMNAGAA
SCHEMBL6132573 0.86 MAPT (0.42) MAPTTP53LMNACA12CA1
Hydrochloric Acid SCHEMBL6133899 0.84 CHEK1 (0.42) MAPTTP53LMNACA12CA1
Hydrochloric Acid SCHEMBL6134789 0.84 CHEK1 (0.42) MAPTTP53LMNACA12CA1
SCHEMBL6132167 0.84 CSNK2A2 (0.46) CHEK1USP2
SCHEMBL6134796 0.84 HDAC3 (0.40) MAPTTP53LMNACA12CA1
SCHEMBL6132353 0.83 CSNK2A2 (0.45) CHEK1USP2

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-20050261177-A1 Compound ASTELLAS PHARMA INC. (JP) 2005-11-24 US disclosed
EP-1366066-A2 CYCLOHEXAPEPTIDE HAVING ANTIMICROBIAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-12-03 EP disclosed
WO-2002072621-A2 CYCLOHEXAPEPTIDE HAVING ANTIMICROBIAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-09-19 WO 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-20050261177-A1 Compound MANBA, MAN2B1, MAN2A1 MAPT 1629/4885TP53 3972/4885LMNA 2671/4885

“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.