SCHEMBL7246382

SCHEMBL7246382

CC(C)(C)c1ccc(C(=O)Nc2cccc(C(=O)Nc3cccc(N)n3)c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNK9 Q9NPC2 1/20 0.62
KCNK3 O14649 1/20 0.60
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
NR1H4 Q96RI1 6/20 0.54
HDAC8 Q9BY41 2/20 0.53
HDAC6 Q9UBN7 2/20 0.53
HDAC3 O15379 1/20 0.53
NPC1 O15118 4/20 0.53
RAB9A P51151 4/20 0.53
SMN1; SMN2 Q16637 3/20 0.52
TP53 P04637 2/20 0.52
MAPT P10636 2/20 0.52
THRB P10828 1/20 0.52
MEN1 O00255 1/20 0.52
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
NFKB1 P19838 1/20 0.52
NFKB2 Q00653 1/20 0.52
KMT2A Q03164 1/20 0.52

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
SCHEMBL14268547 0.80 KMT2A (0.61) NPC1RAB9AMEN1KMT2A
SCHEMBL5224812 0.80 NR1H4 (0.61) CA1CA2NR1H4NPC1RAB9A
SCHEMBL13762080 0.79 KCNK9 (0.76) KCNK9KCNK3CA1CA2NR1H4
SCHEMBL7295509 0.79 KCNK9 (0.80) KCNK9KCNK3CA1CA2NR1H4
SCHEMBL7301884 0.78 PTGS1 (0.74) KCNK9KCNK3CA1CA2NR1H4
SCHEMBL14195814 0.78 KCNK9 (0.83) KCNK9KCNK3CA1CA2NR1H4
SCHEMBL2664554 0.77 KMT2A (0.77) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL21588759 0.76 PTGS1 (0.72) KCNK9KCNK3CA1CA2HDAC8
SCHEMBL13561213 0.76 KCNK9 (0.83) KCNK9KCNK3CA1CA2NR1H4
SCHEMBL21652317 0.75 GRM5 (0.69) NPC1RAB9ASMN1; SMN2TP53MAPT

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-6605626-B2 Benzamide inhibitors of factor Xa ELI LILLY AND COMPANY 2003-08-12 US disclosed
US-20020120007-A1 Benzamide inhibitors of factor Xa BEIGHT DOUGLAS WADE (US) 2002-08-29 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-20020120007-A1 Benzamide inhibitors of factor Xa TFPI, F11, F12 KCNK9 1168/4885KCNK3 2579/4885CA1 1970/4885

“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.