SCHEMBL19476162

SCHEMBL19476162

Cc1ccccc1NC(=O)c1cc2ccccc2[nH]1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.64
RAB9A P51151 3/20 0.64
LMNA P02545 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
CCKAR P32238 1/20 0.62
EGFR P00533 5/20 0.59
PIK3CA P42336 5/20 0.59
KDM4E B2RXH2 1/20 0.59
ALDH1A1 P00352 1/20 0.59
GAA P10253 1/20 0.59
MAPK1 P28482 1/20 0.59
POLB P06746 1/20 0.55
HPGD P15428 1/20 0.55
IDO1 P14902 1/20 0.54
FLT3 P36888 1/20 0.54

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
SCHEMBL12651781 0.90 NPC1 (0.59) NPC1RAB9ALMNASMN1; SMN2CCKAR
SCHEMBL19476086 0.85 NPC1 (0.64) NPC1RAB9ALMNASMN1; SMN2EGFR
SCHEMBL2735821 0.85 RXFP1 (0.58) NPC1RAB9ALMNAKDM4EALDH1A1
SCHEMBL10562380 0.84 NPC1 (0.66) NPC1RAB9ALMNASMN1; SMN2CCKAR
SCHEMBL19476088 0.83 NPC1 (0.61) NPC1RAB9ALMNASMN1; SMN2CCKAR
SCHEMBL19476096 0.83 NPC1 (0.61) NPC1RAB9ALMNASMN1; SMN2CCKAR
SCHEMBL19476097 0.82 NPC1 (0.64) NPC1RAB9ALMNASMN1; SMN2CCKAR
SCHEMBL19476165 0.82 NPC1 (0.64) NPC1RAB9ALMNASMN1; SMN2CCKAR
SCHEMBL19476083 0.82 NPC1 (0.59) NPC1RAB9ALMNASMN1; SMN2CCKAR
SCHEMBL19476164 0.82 CCKAR (0.65) NPC1RAB9ALMNASMN1; SMN2CCKAR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10759765-B2 Heterocyclic carboxylic acid amide ligand and applications thereof in copper catalyzed coupling reaction of aryl halogeno substitute CE PHARM CO., LTD. (CN) 2020-09-01 US disclosed
US-20190127337-A1 HETEROCYCLIC CARBOXYLIC ACID AMIDE LIGAND AND APPLICATIONS THEREOF IN COPPER CATALYZED COUPLING REACTION OF ARYL HALOGENO SUBSTITUTE CE PHARM CO., LTD. (CN) 2019-05-02 US disclosed
EP-3444031-A1 HETEROCYCLIC CARBOXYLIC ACID AMIDE LIGAND AND APPLICATIONS THEREOF IN COPPER CATALYZED COUPLING REACTION OF ARYL HALOGENO SUBSTITUTE Shanghai Institute of Organic Chemistry, Chinese Academy of Sciences (CN) 2019-02-20 EP disclosed
WO-2017177979-A1 HETEROCYCLIC CARBOXYLIC ACID AMIDE LIGAND AND APPLICATIONS THEREOF IN COPPER CATALYZED COUPLING REACTION OF ARYL HALOGENO SUBSTITUTE 中国科学院上海有机化学研究所 2017-10-19 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 (2 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-20190127337-A1 HETEROCYCLIC CARBOXYLIC ACID AMIDE LIGAND AND APPLICATIONS THEREOF IN COPPER CATALYZED COUPLING REACTION OF ARYL HALOGENO SUBSTITUTE AOC1, AOC2, AOC3 NPC1 3545/4885RAB9A 2403/4885LMNA 4664/4885
US-10759765-B2 Heterocyclic carboxylic acid amide ligand and applications thereof in copper catalyzed coupling reaction of aryl halogeno substitute AOC1, AOC2, AOC3 NPC1 3545/4885RAB9A 2403/4885LMNA 4664/4885

“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.