SCHEMBL7919793

SCHEMBL7919793

COC(=O)c1ccc2cccc(-c3cccc(Cl)c3O)c2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.48
TP53 P04637 3/20 0.46
NQO2 P16083 1/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
XDH P47989 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
ALDH1A1 P00352 3/20 0.42
MAPT P10636 6/20 0.41
ALOX15 P16050 1/20 0.41
HTT P42858 1/20 0.41
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40

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
SCHEMBL16502432 0.89 MAPT (0.48) LCKTP53NQO2ALDH1A1MAPT
SCHEMBL7916653 0.88 TP53 (0.46) LCKTP53NQO2ALDH1A1MAPT
SCHEMBL7921781 0.87 TP53 (0.46) LCKTP53NQO2ALDH1A1MAPT
SCHEMBL16502488 0.86 TP53 (0.47) LCKTP53NQO2CA12CA1
SCHEMBL16502586 0.84 LCK (0.48) LCKTP53NQO2CA12CA1
SCHEMBL7919808 0.83 PLA2G2D (0.47) CA12CA1CA2CA9ALDH1A1
SCHEMBL16502581 0.83 ALDH1A1 (0.53) LCKTP53NQO2CA12CA1
SCHEMBL7908929 0.83 PLAU (0.48) LCKTP53NQO2ALDH1A1MAPT
SCHEMBL16502527 0.83 MAPT (0.47) LCKTP53NQO2ALDH1A1MAPT
SCHEMBL7917291 0.83 TP53 (0.43) LCKTP53NQO2ALDH1A1MAPT

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-20110306621-A1 ACYLGUANIDINE DERIVATIVES ASTELLAS PHARMA INC. (JP) 2011-12-15 US disclosed
US-20110306621-A1 ACYLGUANIDINE DERIVATIVES ASTELLAS PHARMA INC. (JP) 2011-12-15 US disclosed
WO-2010090304-A1 ACYLGUANIDINE DERIVATIVE アステラス製薬株式会社 (JP) 2010-08-12 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-20110306621-A1 ACYLGUANIDINE DERIVATIVES HTR5A, HTR2A, HTR1A LCK 2119/4885TP53 2800/4885NQO2 641/4885

“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.