SCHEMBL4249115

SCHEMBL4249115

CCCCCCCCCCN(c1ccccc1)c1ccccc1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.50
JAK2 O60674 1/20 0.50
RAB9A P51151 1/20 0.50
PAX8 Q06710 1/20 0.50
ALDH1A1 P00352 4/20 0.44
TP53 P04637 1/20 0.44
KDM4E B2RXH2 2/20 0.43
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
TACR1 P25103 1/20 0.43
TSHR P16473 2/20 0.42
PTPN11 Q06124 2/20 0.42
PLK1 P53350 2/20 0.42
LMNA P02545 1/20 0.42
ICMT O60725 1/20 0.42
ALB P02768 1/20 0.42
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
PTPN1 P18031 1/20 0.42
MEN1 O00255 1/20 0.41

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
SCHEMBL11689679 1.00 NPC1 (0.50) NPC1JAK2RAB9APAX8ALDH1A1
SCHEMBL11690630 0.90 LTB4R2 (0.48) NPC1JAK2RAB9APAX8ALDH1A1
SCHEMBL4897611 0.88 TP53 (0.47) ALDH1A1TP53KDM4EPOLBGAA
SCHEMBL9303599 0.83 ALDH1A1 (0.49) NPC1JAK2RAB9APAX8ALDH1A1
SCHEMBL5862952 0.83 ALDH1A1 (0.49) NPC1JAK2RAB9APAX8ALDH1A1
SCHEMBL3514125 0.83 GAA (0.44) NPC1JAK2RAB9APAX8ALDH1A1
SCHEMBL11690495 0.82 NR4A1 (0.46) PTPN1
SCHEMBL11690388 0.82 KDM4E (0.47) NPC1JAK2RAB9APAX8ALDH1A1
SCHEMBL3784268 0.81 ALDH1A1 (0.50) NPC1JAK2RAB9APAX8ALDH1A1
SCHEMBL22452807 0.81 KDM4E (0.45) NPC1JAK2RAB9APAX8ALDH1A1

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-20090131527-A1 NOVEL ANTHRANILIC ACID DERIVATIVES AND CHLORIDE CHANNEL BLOCKING AGENT CONTAINING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-05-21 US claimed
US-20090131527-A1 NOVEL ANTHRANILIC ACID DERIVATIVES AND CHLORIDE CHANNEL BLOCKING AGENT CONTAINING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-05-21 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-20090131527-A1 NOVEL ANTHRANILIC ACID DERIVATIVES AND CHLORIDE CHANNEL BLOCKING AGENT CONTAINING THE SAME CLIC1, ASIC1, CLIC4 NPC1 1477/4885JAK2 2451/4885RAB9A 870/4885

“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.