SCHEMBL17488046

SCHEMBL17488046

CCn1c(NCc2ccc(Oc3ncc(Cl)cn3)cc2)nc2ccc(Nc3cc(C(C)(C)C)[nH]n3)cc21

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
TP53 P04637 1/20 0.40
PIK3C3 Q8NEB9 1/20 0.39
P2RX3 P56373 10/20 0.38
THRB P10828 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
GAA P10253 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 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
SCHEMBL17488331 0.93 LMNA (0.39) LMNATP53PIK3C3P2RX3THRB
SCHEMBL17488140 0.92 PIK3C3 (0.40) TP53PIK3C3P2RX3SMN1; SMN2NPC1
SCHEMBL18965877 0.91 TP53 (0.39) LMNATP53PIK3C3P2RX3THRB
SCHEMBL17487846 0.90 LMNA (0.41) LMNATP53PIK3C3P2RX3THRB
SCHEMBL18965888 0.88 P2RX3 (0.39) LMNATP53PIK3C3P2RX3THRB
SCHEMBL17487851 0.85 NPC1 (0.39) TP53PIK3C3SMN1; SMN2NPC1RAB9A
SCHEMBL17488256 0.84 CYP3A4 (0.39) LMNATP53P2RX3
SCHEMBL17488047 0.83 P2RX3 (0.40) LMNATP53P2RX3THRBSMN1; SMN2
SCHEMBL18965976 0.83 LMNA (0.41) LMNATP53P2RX3THRBSMN1; SMN2
SCHEMBL18965884 0.81 LMNA (0.39) LMNATP53P2RX3THRBSMN1; SMN2

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 LMNA 1905/4885TP53 2004/4885PIK3C3 4729/4885

“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.