SCHEMBL5523916

SCHEMBL5523916

O=C(Nc1ccccc1)c1cccc(Nc2ncc(-c3ccsc3)cn2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 2/20 0.52
KCNK9 Q9NPC2 2/20 0.52
HPGD P15428 1/20 0.51
HDAC1 Q13547 4/20 0.48
HDAC2 Q92769 2/20 0.48
HDAC6 Q9UBN7 2/20 0.48
HDAC3 O15379 1/20 0.48
ABL1 P00519 2/20 0.47
PDGFRB P09619 2/20 0.47
KDR P35968 1/20 0.47
BTK Q06187 3/20 0.47
BLK P51451 1/20 0.46
MEN1 O00255 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
KMT2A Q03164 1/20 0.46
AURKA O14965 1/20 0.46
PRKD3 O94806 1/20 0.46
PRKCG P05129 1/20 0.46
PRKCB P05771 1/20 0.46

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
SCHEMBL5495448 0.88 RHOA (0.53) HDAC1HDAC2HDAC6HDAC3ABL1
SCHEMBL5500283 0.85 CTSC (0.51) AURKACTSLCTSCSYK
SCHEMBL5500805 0.83 RHOA (0.48) HDAC1HDAC2HDAC6HDAC3ABL1
SCHEMBL5496439 0.82 KCNK3 (0.50) KCNK3KCNK9HDAC1HDAC2HDAC6
SCHEMBL5494755 0.80 CTSC (0.64) ABL1PDGFRBNPC1RAB9AAURKA
SCHEMBL5513122 0.80 CTSC (0.52) KCNK3KCNK9HDAC1HDAC2HDAC6
SCHEMBL29818135 0.79 NPC1 (0.63) KCNK3HPGDHDAC1HDAC2HDAC6
SCHEMBL5534432 0.78 CTSC (0.52) HDAC1ABL1PDGFRBKDRBTK
SCHEMBL5499926 0.78 POLB (0.51) HDAC1ABL1PDGFRBKDRMEN1
SCHEMBL5499256 0.77 RHOA (0.42) HDAC1HDAC2HDAC6HDAC3ABL1

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-20070293484-A1 Thiophene Heteroaryl Amines SUGEN, INC. 2007-12-20 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-20070293484-A1 Thiophene Heteroaryl Amines TTK, CHEK2, ABL1 KCNK3 1750/4885KCNK9 2950/4885HPGD 2627/4885

“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.