SCHEMBL10163657

SCHEMBL10163657

COc1ccc(Br)c(C(=O)N(C)c2cccc3c(C4=CCCCC4)c(OC)c(OC)cc23)c1OC

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.33
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PSMB5 P28074 1/20 0.33
HTT P42858 1/20 0.32
TUBB4A P04350 1/20 0.32
TUBB P07437 1/20 0.32
TUBA3C P0DPH7 1/20 0.32
TUBA1B P68363 1/20 0.32
TUBA4A P68366 1/20 0.32
TUBB4B P68371 1/20 0.32
TUBB3 Q13509 1/20 0.32
TUBB2A Q13885 1/20 0.32
TUBB8 Q3ZCM7 1/20 0.32
TUBA3E Q6PEY2 1/20 0.32
TUBA1A Q71U36 1/20 0.32
TUBA1C Q9BQE3 1/20 0.32
TUBB6 Q9BUF5 1/20 0.32
TUBB2B Q9BVA1 1/20 0.32

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
SCHEMBL10132675 0.93 PSMB5 (0.34) ALDH1A1RAB9ANPC1SMN1; SMN2PSMB5
SCHEMBL10162955 0.86 PDE3B (0.39) HTTTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL10163166 0.83 TUBB4A (0.42) ALDH1A1RAB9ASMN1; SMN2HTTTUBB4A
SCHEMBL10163248 0.81 TUBB4A (0.41) ALDH1A1RAB9AHTTTUBB4ATUBB
SCHEMBL10163138 0.81 KMT2A (0.41) ALDH1A1RAB9ANPC1SMN1; SMN2GAA
SCHEMBL10163168 0.81 GAA (0.39) ALDH1A1RAB9ANPC1SMN1; SMN2HTT
SCHEMBL10162973 0.79 HTT (0.35) ALDH1A1HTTTUBB4ATUBBTUBA3C
SCHEMBL10163179 0.79 TUBB4A (0.41) ALDH1A1HTTTUBB4ATUBBTUBA3C
SCHEMBL10163013 0.79 ABCB1 (0.47) NPC1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL10161750 0.77 TUBB4A (0.43) ALDH1A1RAB9AHTTTUBB4ATUBB

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 ALDH1A1 3095/4885RAB9A 3576/4885NPC1 2668/4885

“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.