SCHEMBL17488029

SCHEMBL17488029

Cc1cc(Nc2ccc3nc(NCc4ccc(Oc5ncc(Cl)cn5)cc4)[nH]c3c2)n[nH]1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TP53 P04637 1/20 0.43
HTT P42858 2/20 0.41
LMNA P02545 1/20 0.41
GFER P55789 1/20 0.41
HIF1A Q16665 1/20 0.41
PLK4 O00444 4/20 0.41
NTRK1 P04629 3/20 0.41
PAK4 O96013 2/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
GSK3B P49841 3/20 0.38
PIK3C3 Q8NEB9 1/20 0.38
RET P07949 3/20 0.38
AURKA O14965 2/20 0.38
SRC P12931 1/20 0.38
DAPK3 O43293 1/20 0.38
JAK2 O60674 1/20 0.38

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
SCHEMBL17488028 0.93 PLK4 (0.41) RAB9ASMN1; SMN2TP53HTTPLK4
SCHEMBL17488143 0.90 RAB9A (0.40) RAB9ASMN1; SMN2TP53HTTLMNA
SCHEMBL17488153 0.87 RAB9A (0.43) RAB9ASMN1; SMN2TP53HTTLMNA
SCHEMBL17488330 0.86 PLK4 (0.39) HTTPLK4NTRK1PAK4MEN1
SCHEMBL17488145 0.84 RAB9A (0.41) RAB9ASMN1; SMN2TP53HTTLMNA
SCHEMBL17488061 0.83 NTRK1 (0.48) RAB9ASMN1; SMN2TP53PLK4NTRK1
SCHEMBL17488243 0.82 PLK4 (0.42) RAB9ASMN1; SMN2PLK4NTRK1PAK4
SCHEMBL17487497 0.81 RAB9A (0.49) RAB9ASMN1; SMN2TP53HTTLMNA
SCHEMBL17487846 0.81 LMNA (0.41) SMN1; SMN2TP53LMNAPLK4NTRK1
SCHEMBL17487821 0.80 RAB9A (0.43) RAB9ASMN1; SMN2TP53HTTLMNA

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-20170166563-A1 2-AMINO-BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS 5-LIPOXYGENASE AND/OR PROSTAGLANDIN E SYNTHASE INHIBITORS INSTITUT PASTEUR KOREA (KR) 2017-06-15 US disclosed
WO-2016016421-A1 2-AMINO-BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS 5-LIPOXYGENASE AND/OR PROSTAGLANDIN E SYNTHASE INHIBITORS INSTITUT PASTEUR KOREA (KR) 2016-02-04 WO 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-20170166563-A1 2-AMINO-BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS 5-LIPOXYGENASE AND/OR PROSTAGLANDIN E SYNTHASE INHIBITORS ALOX5, ALOX15, ALOX12 RAB9A 3982/4885SMN1; SMN2 3381/4885TP53 2004/4885

“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.