SCHEMBL6416319

SCHEMBL6416319

NN=C(c1cc(Cl)ccc1O)c1nc2nonc2nc1Nc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.42
MAPT P10636 4/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
POLB P06746 1/20 0.42
CDK9 P50750 1/20 0.40
TMPRSS4 Q9NRS4 2/20 0.39
CXCR2 P25025 1/20 0.35
PIM1 P11309 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
ALK Q9UM73 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
P2RX1 P51575 1/20 0.34
P2RX4 Q99571 1/20 0.34
P2RX7 Q99572 1/20 0.34
NPC1 O15118 1/20 0.34
USP2 O75604 1/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34

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
SCHEMBL6416311 1.00 TP53 (0.42) TP53MAPTSMN1; SMN2POLBCDK9
SCHEMBL6418345 0.93 TP53 (0.43) TP53MAPTSMN1; SMN2POLBTMPRSS4
SCHEMBL6418364 0.93 TP53 (0.43) TP53MAPTSMN1; SMN2POLBTMPRSS4
SCHEMBL6418411 0.90 P2RX1 (0.41) TP53MAPTSMN1; SMN2POLBCDK9
SCHEMBL6418425 0.90 P2RX1 (0.41) TP53MAPTSMN1; SMN2POLBCDK9
SCHEMBL6432637 0.87 TP53 (0.35) TP53MAPTSMN1; SMN2POLBPIM1
SCHEMBL6432628 0.87 TP53 (0.35) TP53MAPTSMN1; SMN2POLBPIM1
SCHEMBL6415756 0.87 TP53 (0.41) TP53MAPTSMN1; SMN2POLBPIM1
SCHEMBL6415753 0.87 TP53 (0.41) TP53MAPTSMN1; SMN2POLBPIM1
SCHEMBL6419263 0.86 MAPT (0.39) TP53MAPTSMN1; SMN2POLBMEN1

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-20050143382-A1 Heterocyclic compounds as pharmaceutically active compounds 4SC AG (DE) 2005-06-30 US disclosed
EP-1529531-A1 Oxadiazolopyrazine derivatives as pharmaceutically active compounds 4SC AG (DE) 2005-05-11 EP 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-20050143382-A1 Heterocyclic compounds as pharmaceutically active compounds NR5A2, NR1H2, NR2C2 TP53 4485/4885MAPT 4420/4885SMN1; SMN2 4369/4885

“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.