SCHEMBL13057764

SCHEMBL13057764

N/C(=C/c1ccccn1)P(c1ccccc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.51
RAB9A P51151 5/20 0.45
NPC1 O15118 4/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
ATM Q13315 1/20 0.45
MAOA P21397 1/20 0.40
KDM4E B2RXH2 3/20 0.39
GAA P10253 1/20 0.39
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GRM4 Q14833 1/20 0.38
G6PC1 P35575 1/20 0.37
NR4A1 P22736 1/20 0.37
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MAPT P10636 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL15527490 0.77 RAB9A (0.50) TDP1RAB9ANPC1MEN1KMT2A
SCHEMBL15364024 0.76 TDP1 (0.47) TDP1RAB9ANPC1MEN1KMT2A
SCHEMBL15364026 0.76 TDP1 (0.47) TDP1RAB9ANPC1MEN1KMT2A
SCHEMBL25415051 0.73 TDP1 (0.67) TDP1RAB9ANPC1MEN1KMT2A
SCHEMBL18803863 0.70 TDP1 (0.62) TDP1RAB9ANPC1MEN1KMT2A
SCHEMBL28199042 0.69 TDP1 (0.52) TDP1RAB9ANPC1MEN1KMT2A
SCHEMBL14611861 0.68 TDP1 (0.71) TDP1RAB9ANPC1MEN1KMT2A
SCHEMBL11451952 0.68 TDP1 (1.00) TDP1RAB9ANPC1MEN1KMT2A
SCHEMBL7521932 0.68 TDP1 (0.71) TDP1RAB9ANPC1MEN1KMT2A
SCHEMBL9445874 0.68 RAB9A (0.60) TDP1RAB9ANPC1MEN1KMT2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298569-A1 USE OF CYCLOVINYL PHOSPHINE/COPPER COMPLEXES AS ARYLATION CATALYSTS CENTRE NATIONAL DE RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2010-11-25 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-20100298569-A1 USE OF CYCLOVINYL PHOSPHINE/COPPER COMPLEXES AS ARYLATION CATALYSTS CPNE4, CBR3, DDT TDP1 4230/4885RAB9A 2821/4885NPC1 3877/4885

“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.