SCHEMBL17488142

SCHEMBL17488142

Cc1cc(Nc2ccc3nc(NCc4ccc(Oc5ncc(Cl)cn5)c(Cl)c4)n(C)c3c2)n[nH]1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLK4 O00444 10/20 0.38
RAB9A P51151 5/20 0.37
NPC1 O15118 4/20 0.37
KMT2A Q03164 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NTRK1 P04629 4/20 0.37
PAK4 O96013 2/20 0.37
MEN1 O00255 1/20 0.36
HTT P42858 1/20 0.36
HSD17B10 Q99714 1/20 0.36
JAK2 O60674 1/20 0.35
JAK3 P52333 1/20 0.35
GAA P10253 1/20 0.34
ATM Q13315 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
SCHEMBL17488243 0.89 PLK4 (0.42) PLK4RAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL17488030 0.84 PLK4 (0.46) PLK4RAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL17488019 0.83 PLK4 (0.42) PLK4RAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL17487846 0.81 LMNA (0.41) PLK4SMN1; SMN2NTRK1PAK4JAK2
SCHEMBL17488023 0.81 CYP3A4 (0.47) PLK4RAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL17487993 0.81 RAB9A (0.43) RAB9ANPC1KMT2ASMN1; SMN2HTT
SCHEMBL17488148 0.80 NTRK1 (0.41) PLK4RAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL17487989 0.80 RAB9A (0.38) RAB9ANPC1KMT2ASMN1; SMN2MEN1
SCHEMBL18965983 0.79 PLK4 (0.42) PLK4KMT2ANTRK1PAK4MEN1
SCHEMBL17487532 0.79 PLK4 (0.40) PLK4NTRK1PAK4JAK2JAK3

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 PLK4 3683/4885RAB9A 3982/4885NPC1 2764/4885

“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.