SCHEMBL10132453

SCHEMBL10132453

C[n+]1cc2c3c(c(-c4ccc5[nH]cnc5c4)cc2c2ccc4cc5c(cc4c21)OCO5)OCO3

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.55
MAPT P10636 5/20 0.55
HPGD P15428 5/20 0.55
MAPK1 P28482 5/20 0.55
SMN1; SMN2 Q16637 5/20 0.55
KMT2A Q03164 4/20 0.55
KDM4E B2RXH2 3/20 0.55
MEN1 O00255 3/20 0.55
LMNA P02545 3/20 0.55
TP53 P04637 3/20 0.55
CYP3A4 P08684 3/20 0.55
ALOX15 P16050 3/20 0.55
ALOX12 P18054 3/20 0.55
HSD17B10 Q99714 3/20 0.55
BCHE P06276 3/20 0.55
ACHE P22303 3/20 0.55
BAD Q92934 3/20 0.55
RGS17 Q9UGC6 2/20 0.55
RGS12 O14924 2/20 0.55
NPC1 O15118 2/20 0.55

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
SCHEMBL10132452 0.87 ALDH1A1 (0.52) ALDH1A1MAPTHPGDMAPK1SMN1; SMN2
SCHEMBL10132455 0.84 BAD (0.53) ALDH1A1MAPTHPGDMAPK1SMN1; SMN2
SCHEMBL10132457 0.83 BAD (0.52) ALDH1A1MAPTHPGDMAPK1SMN1; SMN2
SCHEMBL10132463 0.83 TDP1 (0.51) ALDH1A1MAPTHPGDMAPK1SMN1; SMN2
SCHEMBL10132407 0.80 BAD (0.65) ALDH1A1MAPTHPGDMAPK1SMN1; SMN2
SCHEMBL13284359 0.80 ALDH1A1 (0.55) ALDH1A1MAPTHPGDMAPK1SMN1; SMN2
SCHEMBL10132460 0.79 BAD (0.53) ALDH1A1MAPTHPGDMAPK1SMN1; SMN2
SCHEMBL10132461 0.78 MAPK1 (0.47) ALDH1A1MAPTHPGDMAPK1SMN1; SMN2
SCHEMBL13284128 0.76 ALDH1A1 (0.56) ALDH1A1MAPTHPGDMAPK1SMN1; SMN2
SCHEMBL13284360 0.75 ALDH1A1 (0.55) ALDH1A1MAPTHPGDMAPK1SMN1; SMN2

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 2 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

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 3095/4885MAPT 4875/4885HPGD 1643/4885

“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.