SCHEMBL10163156

SCHEMBL10163156

COc1ccc(Br)c(C(=O)O)c1OC(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA7 P43166 2/20 0.43
CA9 Q16790 2/20 0.43
CA14 Q9ULX7 2/20 0.43
MAPT P10636 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
LCK P06239 1/20 0.40
FYN P06241 1/20 0.40
ALDH1A1 P00352 3/20 0.39
KMT2A Q03164 4/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2D6 P10635 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C19 P33261 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
TPMT P51580 1/20 0.38
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
SCHEMBL421547 0.85 MAPT (0.51) CA12CA1CA2CA7CA9
Hydrochloric Acid SCHEMBL422457 0.83 MAPT (0.50) CA12CA1CA2CA7CA9
SCHEMBL10132653 0.81 KMT2A (0.40) TDP1ALDH1A1KMT2AHPGDKDM4E
SCHEMBL8386396 0.78 KMT2A (0.44) CA12CA1CA2CA7CA9
SCHEMBL15813854 0.78 XDH (0.40) CA12CA1CA2CA7CA9
SCHEMBL27883374 0.76 MAPT (0.57) CA12CA1CA2CA7CA9
SCHEMBL10693494 0.75 MAPT (0.49) CA12CA1CA2CA7CA9
SCHEMBL1323122 0.75 CA12 (0.55) CA12CA1CA2CA7CA9
SCHEMBL2171213 0.75 ERN1 (0.54) CA12CA1CA2CA7CA9
SCHEMBL6825647 0.75 CA12 (0.50) CA12CA1CA2CA7CA9

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-8741917-B2 Benzo [C] phenanthridines as antimicrobial agents RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2014-06-03 US disclosed
US-20120022061-A1 BENZO [C] PHENANTHRIDINES AS ANTIMICROBIAL AGENTS RUGTERS, THE STATE UNIVERSITY OF NEW JERSEY 2012-01-26 US disclosed
WO-2010083436-A1 BENZO [C] PHENANTHRIDINES AS ANTIMICROBIAL AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2010-07-22 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-20120022061-A1 BENZO [C] PHENANTHRIDINES AS ANTIMICROBIAL AGENTS CCNT1, XPO4, XDH CA12 2824/4885CA1 3543/4885CA2 1025/4885

“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.