SCHEMBL20094583

SCHEMBL20094583

O=CCCc1c(C=O)[nH]c2ccc(Cl)cc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
ADRA2A P08913 1/20 0.43
ADRA2B P18089 1/20 0.43
ADRA2C P18825 1/20 0.43
HTR7 P34969 1/20 0.43
HTR2B P41595 1/20 0.43
HTR6 P50406 1/20 0.43
SIRT1 Q96EB6 5/20 0.41
SIRT2 Q8IXJ6 1/20 0.40
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP1A2 P05177 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
AHR P35869 1/20 0.38
CNR1 P21554 2/20 0.38
CA12 O43570 1/20 0.37
CA9 Q16790 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
SCHEMBL28437263 0.76 LMNA (0.51) LMNAMEN1ALDH1A1MAPTKMT2A
SCHEMBL27574887 0.74 SIRT1 (0.51) SIRT1SIRT2MEN1ALDH1A1MAPT
SCHEMBL14068343 0.73 LMNA (0.49) LMNAMEN1ALDH1A1MAPTKMT2A
SCHEMBL29956275 0.73 LMNA (0.57) LMNAADRA2AADRA2BADRA2CHTR7
SCHEMBL27531831 0.71 SIRT1 (0.50) SIRT1SIRT2MEN1ALDH1A1MAPT
SCHEMBL21731624 0.71 HTR2A (0.47) LMNAADRA2AADRA2BADRA2CHTR7
SCHEMBL5793847 0.70 HTR2A (0.65) LMNAADRA2AADRA2BADRA2CHTR7
SCHEMBL10740843 0.69 TDP1 (0.35) AHR
SCHEMBL10745098 0.69 TDP1 (0.35) AHR
SCHEMBL10745606 0.69 TP53 (0.37) LMNAADRA2AADRA2BADRA2CHTR7

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-11339189-B2 DNA primase and gyrase inhibitors B. G. NEGEV TECHNOLOGIES AND APPLICATIONS LTD., AT BEN-GURION UNIVERSITY (IL) 2022-05-24 US disclosed
US-20190248836-A1 DNA PRIMASE AND GYRASE INHIBITORS B. G. NEGEV TECHNOLOGIES AND APPLICATIONS LTD., AT BEN-GURION UNIVERSITY (IL) 2019-08-15 US disclosed
WO-2018073828-A1 DNA PRIMASE AND GYRASE INHIBITORS B. G. NEGEV TECHNOLOGIES AND APPLICATIONS LTD., AT BEN-GURION UNIVERSITY (IL) 2018-04-26 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 (2 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-20190248836-A1 DNA PRIMASE AND GYRASE INHIBITORS TOP2A, TOP1, DNA2 LMNA 741/4885ADRA2A 4786/4885ADRA2B 4764/4885
US-11339189-B2 DNA primase and gyrase inhibitors TOP2A, TOP1, DNA2 LMNA 741/4885ADRA2A 4786/4885ADRA2B 4764/4885

“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.