SCHEMBL10132624

SCHEMBL10132624

COc1cc2c(N(C)C(=O)c3c(Br)ccc4c3OCO4)cccc2c(Cc2ccccc2)c1OC

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 3/20 0.39
EDNRB P24530 2/20 0.39
ALDH1A1 P00352 4/20 0.38
LMNA P02545 4/20 0.38
HTT P42858 2/20 0.38
TARBP2 Q15633 2/20 0.37
HPGD P15428 3/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 2/20 0.35
TACR1 P25103 1/20 0.35
KMT2A Q03164 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
MEN1 O00255 1/20 0.35

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
SCHEMBL10132602 0.87 NPSR1 (0.43) EDNRAEDNRBALDH1A1LMNAHTT
SCHEMBL10132591 0.85 NPSR1 (0.42) EDNRAEDNRBALDH1A1LMNAHTT
SCHEMBL10132623 0.83 ALDH1A1 (0.42) EDNRAEDNRBALDH1A1LMNATARBP2
SCHEMBL10132636 0.82 NPSR1 (0.42) EDNRAEDNRBLMNATARBP2MAPT
SCHEMBL10132869 0.81 CYP19A1 (0.36) EDNRAALDH1A1LMNAHTTHPGD
SCHEMBL419335 0.78 NPSR1 (0.38) EDNRAEDNRBALDH1A1LMNAHTT
Benzamide SCHEMBL424272 0.74 NPSR1 (0.37) EDNRAEDNRBHTTTARBP2HPGD
SCHEMBL10163166 0.71 TUBB4A (0.42) ALDH1A1LMNAHTTHPGDMAPT
SCHEMBL10163248 0.69 TUBB4A (0.41) ALDH1A1LMNAHTTMAPTTACR1
SCHEMBL10132696 0.69 TUBB4A (0.41) ALDH1A1LMNAHTTHPGDTACR1

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 5 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-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
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 EDNRA 1983/4885EDNRB 1588/4885ALDH1A1 3095/4885

“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.