SCHEMBL10132877

SCHEMBL10132877

COc1cc2cccc(N(C)C(=O)c3c(Br)ccc(C)c3OC)c2cc1OC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 2/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 1/20 0.38
POLB P06746 1/20 0.36
HTT P42858 1/20 0.35
APAF1 O14727 1/20 0.35
TDP2 O95551 1/20 0.35
NSD2 O96028 1/20 0.35
CASP3 P42574 1/20 0.35
PPP1CA P62136 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
SAE1 Q9UBE0 1/20 0.35
UBA2 Q9UBT2 1/20 0.35
HCRTR2 O43614 3/20 0.35
HCRTR1 O43613 2/20 0.35
PDE1A P54750 1/20 0.35
PDE1B Q01064 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
SCHEMBL10161868 0.91 ALDH1A1 (0.40) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL10132688 0.82 TUBB4A (0.33) ALDH1A1KDM4EPOLBHTTGPBAR1
SCHEMBL10132696 0.82 TUBB4A (0.41) ALDH1A1KDM4EHPGDHTTRAB9A
SCHEMBL10132737 0.81 HTT (0.38) ALDH1A1HPGDPOLBHTTRAB9A
SCHEMBL10132643 0.80 TUBB4A (0.40) ALDH1A1KDM4EHPGDPOLBHTT
SCHEMBL10132869 0.79 CYP19A1 (0.36) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL10132801 0.78 TUBB4A (0.40) ALDH1A1HTTGPBAR1
SCHEMBL10132675 0.77 PSMB5 (0.34) ALDH1A1RAB9AMEN1KMT2A
SCHEMBL10132847 0.77 ABCB1 (0.45) ALDH1A1KDM4EHPGDHSD17B10HTT
SCHEMBL10132874 0.77 KDM4E (0.44) ALDH1A1KDM4EHPGDHSD17B10POLB

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 3095/4885KDM4E 536/4885HPGD 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.