SCHEMBL424330

SCHEMBL424330

O=c1[nH]c2c3ccccc3ccc2c2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.60
CDC25A P30304 1/20 0.56
CDC25C P30307 1/20 0.56
PARP1 P09874 7/20 0.56
KDM4E B2RXH2 4/20 0.54
ALDH1A1 P00352 4/20 0.54
HPGD P15428 2/20 0.54
HTT P42858 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
HSD17B10 Q99714 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
TNKS O95271 2/20 0.50
PARP15 Q460N3 2/20 0.50
TNKS2 Q9H2K2 2/20 0.50
HPRT1 P00492 1/20 0.50
LMNA P02545 1/20 0.50
CYP1A2 P05177 1/20 0.50
GPR3 P46089 1/20 0.50
BLM P54132 1/20 0.50

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
SCHEMBL28758305 0.83 KIF11 (0.69) KIF11CDC25ACDC25CKDM4EALDH1A1
SCHEMBL29250372 0.83 KIF11 (0.69) KIF11CDC25ACDC25CKDM4EALDH1A1
SCHEMBL33523872 0.83 KIF11 (0.69) KIF11CDC25ACDC25CKDM4EALDH1A1
SCHEMBL29368226 0.83 KIF11 (0.75) KIF11CDC25ACDC25CKDM4EALDH1A1
SCHEMBL5466693 0.83 KIF11 (0.75) KIF11CDC25ACDC25CKDM4EALDH1A1
SCHEMBL30914261 0.83 KIF11 (0.75) KIF11CDC25ACDC25CKDM4EALDH1A1
SCHEMBL3472897 0.82 KIF11 (0.53) KIF11CDC25ACDC25CPARP1KDM4E
SCHEMBL23132405 0.81 CDK4 (0.50) KIF11CDC25ACDC25CPARP1KDM4E
SCHEMBL23530348 0.79 KIF11 (0.59) KIF11CDC25ACDC25CPARP1KDM4E
SCHEMBL11995709 0.78 PARP1 (0.55) PARP1KDM4EALDH1A1HPGDHTT

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 KIF11 4361/4885CDC25A 39/4885CDC25C 28/4885

“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.